| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39 | Very low | 37.9 | Very low | 230 Ų | 230 | 156.5 Ų | 156.5 | 100% | 1.133 | 80% | 0.796 | S | S | * | * | 0 | 95 | 0 | -71.9 | 167 | 163.8 | 0 | 0 | 105.9 | |||||
| 2 | L | 40.9 | Very low | 37.4 | Very low | 146 Ų | 146 | 163.8 Ų | 163.8 | 76% | 0.764 | 81% | 0.807 | S | S | * | * | 76.3 | 102.9 | 108.8 | -67 | 168.2 | 0 | 0 | 0 | 110.4 | |||||
| 3 | D | 37.5 | Very low | 36.9 | Very low | 157 Ų | 157 | 159.1 Ų | 159.1 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | 66.6 | 139.4 | 77.5 | -73.5 | -59.6 | 0 | 0 | 0 | 112.5 | |||||
| 4 | G | 38.2 | Very low | 37 | Very low | 59 Ų | 59 | 155.4 Ų | 155.4 | 61% | 0.608 | 80% | 0.796 | S | S | * | * | cis | 161.6 | 177.3 | 5.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 5 | L | 44.1 | Very low | 37.1 | Very low | 169 Ų | 169 | 153.3 Ų | 153.3 | 89% | 0.885 | 80% | 0.797 | S | S | * | * | trans | 78.2 | 112.3 | -178.7 | -53.6 | 167.4 | 0 | 0 | 0 | 114.7 | ||||
| 6 | R | 39.9 | Very low | 37.2 | Very low | 203 Ų | 203 | 158.7 Ų | 158.7 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | cis | 68.6 | 124.4 | 37.9 | -144.9 | -172.7 | -162.1 | -162.2 | 6.1 | 109.9 | ||||
| 7 | R | 39.4 | Very low | 37.5 | Very low | 191 Ų | 191 | 155.6 Ų | 155.6 | 72% | 0.721 | 80% | 0.797 | S | S | * | * | -179.3 | 131.2 | 54.2 | -171.1 | -169.8 | -63.4 | -112.6 | 6.7 | 106.3 | |||||
| 8 | R | 38.6 | Very low | 37.2 | Very low | 208 Ų | 208 | 156.1 Ų | 156.1 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | 70 | 118.1 | 60.9 | -118.3 | -152.3 | -96.6 | -166.8 | -1.6 | 118.2 | |||||
| 9 | H | 34.6 | Very low | 36.8 | Very low | 156 Ų | 156 | 152.7 Ų | 152.7 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | trans | 89.7 | 130.7 | 154.4 | -67.8 | -64.8 | 0 | 0 | 0 | 124.3 | ||||
| 10 | A | 32.6 | Very low | 36.8 | Very low | 97 Ų | 97 | 153.1 Ų | 153.1 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | 68.9 | 148.6 | 141.5 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 11 | S | 32.6 | Very low | 36.5 | Very low | 105 Ų | 105 | 153.1 Ų | 153.1 | 73% | 0.734 | 80% | 0.796 | S | S | * | * | cis | -168.4 | 164.4 | -6.3 | 48.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 12 | R | 31.2 | Very low | 36.4 | Very low | 244 Ų | 244 | 151.7 Ų | 151.7 | 92% | 0.921 | 78% | 0.784 | S | S | * | * | trans | 63.9 | 157.2 | 167.6 | -80.9 | -177.3 | 164.9 | -147.7 | -2.6 | 117 | ||||
| 13 | S | 31.1 | Very low | 35.9 | Very low | 103 Ų | 103 | 150 Ų | 150 | 72% | 0.72 | 78% | 0.784 | S | S | * | * | cis | -157.6 | 164.1 | -10.6 | 39.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 14 | S | 38.2 | Very low | 35.6 | Very low | 107 Ų | 107 | 148.2 Ų | 148.2 | 75% | 0.748 | 78% | 0.779 | S | S | * | * | trans | -69.7 | 169.8 | 176.8 | 60.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 15 | P | 37.9 | Very low | 35.2 | Very low | 125 Ų | 125 | 154.4 Ų | 154.4 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | -143.9 | 138.3 | 107.3 | 35.5 | -20.2 | 0 | 0 | 0 | 117.1 | |||||
| 16 | R | 39.5 | Very low | 34.5 | Very low | 239 Ų | 239 | 151.3 Ų | 151.3 | 90% | 0.902 | 78% | 0.782 | S | S | * | * | trans | -121.9 | 169.9 | 136.6 | -75.7 | -176.6 | 177.2 | 178.3 | -1.2 | 105.2 | ||||
| 17 | P | 41.7 | Very low | 34.3 | Very low | 106 Ų | 106 | 146 Ų | 146 | 69% | 0.688 | 78% | 0.782 | S | S | * | * | cis | -127.8 | -174.3 | 2.1 | 41.6 | -26.1 | 0 | 0 | 0 | 113.1 | ||||
| 18 | L | 32.7 | Very low | 34.5 | Very low | 164 Ų | 164 | 142.4 Ų | 142.4 | 86% | 0.859 | 78% | 0.783 | S | S | * | * | trans | -133 | 98.6 | 154.7 | -78.4 | 179.5 | 0 | 0 | 0 | 110.9 | ||||
| 19 | S | 29.6 | Very low | 34.9 | Very low | 93 Ų | 93 | 138.1 Ų | 138.1 | 65% | 0.65 | 78% | 0.782 | S | S | * | * | trans | -94 | 133.6 | 152.8 | 51.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 20 | L | 37.2 | Very low | 35.4 | Very low | 159 Ų | 159 | 135.7 Ų | 135.7 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | trans | -115.9 | 106.5 | 170.8 | -72.2 | 174.4 | 0 | 0 | 0 | 109.5 | ||||
| 21 | N | 31.1 | Very low | 35.3 | Very low | 154 Ų | 154 | 136.1 Ų | 136.1 | 82% | 0.824 | 78% | 0.777 | S | S | * | * | trans | -99.9 | 156.2 | 171.3 | -89 | -26.1 | 0 | 0 | 0 | 110.5 | ||||
| 22 | F | 35.6 | Very low | 36.1 | Very low | 201 Ų | 201 | 135.9 Ų | 135.9 | 88% | 0.882 | 77% | 0.773 | S | S | * | * | trans | -61 | 147.6 | 177.2 | -77.6 | -108 | 0 | 0 | 0 | 113.5 | ||||
| 23 | S | 31 | Very low | 36.1 | Very low | 110 Ų | 110 | 131.6 Ų | 131.6 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | trans | -155.9 | 110.9 | 155.9 | -70.9 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 24 | T | 31.4 | Very low | 36.3 | Very low | 119 Ų | 119 | 134.8 Ų | 134.8 | 73% | 0.73 | 77% | 0.774 | S | S | * | * | 69 | 114.6 | 83.5 | -56.9 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 25 | F | 30.1 | Very low | 36.1 | Very low | 190 Ų | 190 | 137.4 Ų | 137.4 | 83% | 0.833 | 78% | 0.78 | S | S | * | * | -174.7 | 133.7 | 121.2 | -116.3 | -90.1 | 0 | 0 | 0 | 114 | |||||
| 26 | S | 29.4 | Very low | 35.6 | Very low | 104 Ų | 104 | 134.6 Ų | 134.6 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | 43.5 | 139.7 | 152.1 | -66.5 | 0 | 0 | 0 | 0 | 126.5 | ||||
| 27 | A | 34.1 | Very low | 35.1 | Very low | 91 Ų | 91 | 128.9 Ų | 128.9 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | trans | -81.8 | -165.1 | 156.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 28 | P | 44.3 | Very low | 34.6 | Very low | 116 Ų | 116 | 128.6 Ų | 128.6 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | cis | -132.7 | -145.3 | 2 | 43.8 | -21.4 | 0 | 0 | 0 | 111.2 | ||||
| 29 | P | 46.3 | Very low | 34.7 | Very low | 118 Ų | 118 | 126.3 Ų | 126.3 | 77% | 0.766 | 76% | 0.764 | S | S | * | * | cis | -126.3 | -114.1 | -9.9 | 31.3 | -3.6 | 0 | 0 | 0 | 115.2 | ||||
| 30 | P | 45 | Very low | 34.9 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 68% | 0.675 | 78% | 0.775 | S | S | * | * | trans | -136.7 | 175.3 | -139.1 | 41.7 | -19.1 | 0 | 0 | 0 | 119.9 | ||||
| 31 | S | 32.2 | Very low | 34.6 | Very low | 107 Ų | 107 | 132 Ų | 132 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | trans | 68.2 | 170.7 | 152.5 | 74.6 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 32 | P | 49.6 | Very low | 35.3 | Very low | 99 Ų | 99 | 130.1 Ų | 130.1 | 64% | 0.643 | 77% | 0.772 | S | S | * | * | cis | -130.6 | -161.3 | -43.8 | 30.4 | -9.5 | 0 | 0 | 0 | 112.2 | ||||
| 33 | D | 29.9 | Very low | 35.4 | Very low | 154 Ų | 154 | 130.1 Ų | 130.1 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | trans | 116.9 | 154.3 | 148.7 | -63.3 | -29.8 | 0 | 0 | 0 | 120.1 | ||||
| 34 | M | 36.4 | Very low | 35.6 | Very low | 171 Ų | 171 | 135.9 Ų | 135.9 | 84% | 0.842 | 78% | 0.777 | S | S | * | * | trans | -111 | -176.1 | -151.5 | -85.8 | -77.7 | -162.8 | 0 | 0 | 113.3 | ||||
| 35 | D | 32.3 | Very low | 35.8 | Very low | 161 Ų | 161 | 141.1 Ų | 141.1 | 86% | 0.861 | 78% | 0.783 | S | S | * | * | trans | 81.9 | 131.2 | 165.3 | -59.9 | -26.6 | 0 | 0 | 0 | 117.7 | ||||
| 36 | G | 28.7 | Very low | 36.1 | Very low | 67 Ų | 67 | 138.1 Ų | 138.1 | 69% | 0.691 | 78% | 0.781 | S | S | * | * | cis | 174.9 | 168 | -6.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 37 | S | 29.2 | Very low | 36.3 | Very low | 119 Ų | 119 | 142 Ų | 142 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | trans | 58 | 113.7 | 160.9 | -169.1 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 38 | S | 31.3 | Very low | 36.6 | Very low | 100 Ų | 100 | 146.4 Ų | 146.4 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | -179.6 | 144.3 | 89.1 | -156.5 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 39 | T | 33.7 | Very low | 36.3 | Very low | 116 Ų | 116 | 151.2 Ų | 151.2 | 71% | 0.712 | 80% | 0.8 | S | S | * | * | trans | 66.8 | 96.3 | 152.5 | -31.3 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 40 | E | 33.4 | Very low | 35.6 | Very low | 186 Ų | 186 | 154.2 Ų | 154.2 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | 44.4 | 136.5 | 127.5 | -49.7 | -162.8 | 123.6 | 0 | 0 | 124.4 | |||||
| 41 | H | 31.6 | Very low | 35.3 | Very low | 185 Ų | 185 | 158 Ų | 158 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | trans | -72.6 | -171.9 | 162.9 | -63.6 | -26 | 0 | 0 | 0 | 113.1 | ||||
| 42 | P | 45.8 | Very low | 35.9 | Very low | 115 Ų | 115 | 160.4 Ų | 160.4 | 75% | 0.747 | 82% | 0.818 | S | S | * | * | cis | -132 | 170.3 | -15.9 | 15.1 | 10 | 0 | 0 | 0 | 115.7 | ||||
| 43 | F | 38.3 | Very low | 35 | Very low | 201 Ų | 201 | 164.1 Ų | 164.1 | 88% | 0.882 | 83% | 0.829 | S | S | * | * | trans | -42.1 | 134.1 | 156.1 | -59.6 | -98.1 | 0 | 0 | 0 | 115.4 | ||||
| 44 | R | 34.5 | Very low | 35.2 | Very low | 230 Ų | 230 | 161.9 Ų | 161.9 | 87% | 0.868 | 83% | 0.825 | S | S | * | * | trans | -177.1 | 157.1 | 131 | -104.3 | -167 | -171.6 | -156.7 | 3.9 | 112.5 | ||||
| 45 | R | 36.8 | Very low | 35.2 | Very low | 230 Ų | 230 | 158.8 Ų | 158.8 | 87% | 0.868 | 82% | 0.821 | S | S | * | * | trans | 88.3 | 132 | -174.4 | -54.5 | 168.1 | -175.4 | 94.8 | -5.3 | 111.8 | ||||
| 46 | T | 34.7 | Very low | 35.5 | Very low | 127 Ų | 127 | 157.3 Ų | 157.3 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | cis | -158.4 | 124.2 | 0.8 | 1.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 47 | L | 34.4 | Very low | 35.9 | Very low | 186 Ų | 186 | 159.7 Ų | 159.7 | 97% | 0.974 | 83% | 0.826 | S | S | * | * | trans | -123.8 | 113.7 | 160.1 | -84.7 | 178 | 0 | 0 | 0 | 108.4 | ||||
| 48 | H | 39.6 | Very low | 36.9 | Very low | 182 Ų | 182 | 162 Ų | 162 | 84% | 0.843 | 83% | 0.828 | S | S | * | * | trans | -133.8 | 144.1 | 176 | -153.1 | -94.1 | 0 | 0 | 0 | 108.8 | ||||
| 49 | R | 38.9 | Very low | 37.6 | Very low | 217 Ų | 217 | 162.7 Ų | 162.7 | 82% | 0.819 | 83% | 0.833 | S | S | * | * | trans | 81.9 | 64.1 | 171.6 | -148.5 | -179.4 | -150.9 | 175.7 | 6.4 | 117.6 | ||||
| 50 | L | 31.6 | Very low | 38.2 | Very low | 182 Ų | 182 | 166.1 Ų | 166.1 | 95% | 0.953 | 84% | 0.841 | S | S | * | * | trans | -64.9 | 127.2 | 141 | -73.2 | 169.4 | 0 | 0 | 0 | 108.4 | ||||
| 51 | K | 39.5 | Very low | 38.5 | Very low | 184 Ų | 184 | 163.5 Ų | 163.5 | 80% | 0.8 | 83% | 0.832 | S | S | * | * | trans | -109.9 | 125.5 | 168.8 | -175.5 | 158.4 | 178 | 174.9 | 0 | 108.6 | ||||
| 52 | L | 44.2 | Very low | 39.1 | Very low | 156 Ų | 156 | 158.7 Ų | 158.7 | 82% | 0.817 | 83% | 0.833 | S | S | * | * | trans | -69.7 | 178.4 | 179.2 | -67.1 | 167 | 0 | 0 | 0 | 112.1 | ||||
| 53 | M | 31.1 | Very low | 38.7 | Very low | 177 Ų | 177 | 161.2 Ų | 161.2 | 87% | 0.872 | 83% | 0.832 | S | S | * | * | trans | 86 | 128.2 | 177.6 | -44.4 | -163.8 | 83.5 | 0 | 0 | 113.6 | ||||
| 54 | S | 34.1 | Very low | 38.8 | Very low | 107 Ų | 107 | 156.1 Ų | 156.1 | 75% | 0.748 | 82% | 0.821 | S | S | * | * | cis | -163.4 | 153.3 | -3.5 | 38.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 55 | S | 35.2 | Very low | 38.9 | Very low | 107 Ų | 107 | 152.9 Ų | 152.9 | 75% | 0.748 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 149.6 | 178.1 | -48.3 | 0 | 0 | 0 | 0 | 113.2 | S57 | S55-S57 PolarHBondContact O-N 3.05Š|
| 56 | P | 40.1 | Very low | 39.1 | Very low | 129 Ų | 129 | 150.5 Ų | 150.5 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 116.4 | 172.4 | 31.1 | -31.9 | 0 | 0 | 0 | 110.6 | ||
| 57 | S | 35.6 | Very low | 39.4 | Very low | 117 Ų | 117 | 146.1 Ų | 146.1 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 126.6 | 174 | -61 | 0 | 0 | 0 | 0 | 111.2 | S55 S59 | S55-S57 PolarHBondContact O-N 3.05Å; S57-S59 PolarHBondContact O-N 3.35Å |
| 58 | L | 49.7 | Very low | 39.5 | Very low | 169 Ų | 169 | 139.6 Ų | 139.6 | 89% | 0.885 | 76% | 0.756 | S | S | * | * | trans | -70.6 | 107.6 | 160.2 | -77.6 | 169.3 | 0 | 0 | 0 | 109.1 | ||||
| 59 | S | 47.1 | Very low | 40.1 | Very low | 113 Ų | 113 | 136.5 Ų | 136.5 | 79% | 0.79 | 75% | 0.752 | S | S | * | * | trans | 177.6 | 155.4 | 141.9 | -82 | 0 | 0 | 0 | 0 | 111.5 | S57 | S57-S59 PolarHBondContact O-N 3.35Š| ||
| 60 | E | 46.8 | Very low | 40.5 | Very low | 189 Ų | 189 | 132.8 Ų | 132.8 | 88% | 0.883 | 74% | 0.744 | S | S | * | * | trans | 58.4 | 81.8 | 165.9 | -60 | -169.9 | 146.5 | 0 | 0 | 118 | ||||
| 61 | L | 38.1 | Very low | 41.3 | Very low | 131 Ų | 131 | 126.4 Ų | 126.4 | 69% | 0.686 | 71% | 0.711 | S | S | * | * | -151.1 | 95.1 | 114.3 | -160.5 | 47 | 0 | 0 | 0 | 112.5 | K63 | L61-K63 HydrophobicContact CD1-CG 4.28Å; L61-K63 HydrophobicContact CD2-CD 3.62Å; L61-K63 HydrophobicContact CD2-CG 4.09Å; L61-K63 HydrophobicContact CG-CB 4.26Å; L61-K63 HydrophobicContact CG-CD 3.96Å; L61-K63 HydrophobicContact CG-CG 3.84Å; L61-K63 PolarHBondContact O-N 3.23Å | |||
| 62 | G | 44.7 | Very low | 41.9 | Very low | 84 Ų | 84 | 126.3 Ų | 126.3 | 87% | 0.866 | 71% | 0.705 | S | S | * | * | trans | -69.4 | 55.8 | 164.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S64 | G62-S64 VanDerWaalsContact C-N 3.31Å; G62-S64 PolarHBondContact O-N 2.75Å | ||
| 63 | K | 37 | Very low | 42.7 | Very low | 168 Ų | 168 | 120 Ų | 120 | 73% | 0.73 | 68% | 0.678 | S | S | * | * | trans | -73.3 | 96.2 | 160.1 | -89.6 | 172.4 | -177.2 | 168.9 | 0 | 106.6 | L61 E65 | L61-K63 HydrophobicContact CD1-CG 4.28Å; L61-K63 HydrophobicContact CD2-CD 3.62Å; L61-K63 HydrophobicContact CD2-CG 4.09Å; L61-K63 HydrophobicContact CG-CB 4.26Å; L61-K63 HydrophobicContact CG-CD 3.96Å; L61-K63 HydrophobicContact CG-CG 3.84Å; L61-K63 PolarHBondContact O-N 3.23Å; K63-E65 PolarHBondContact O-N 3.25Å | ||
| 64 | S | 41.8 | Very low | 44 | Very low | 94 Ų | 94 | 117 Ų | 117 | 66% | 0.657 | 66% | 0.662 | S | S | * | * | trans | -50.3 | 105 | 162.5 | 179.3 | 0 | 0 | 0 | 0 | 107.6 | G62 K66 | G62-S64 VanDerWaalsContact C-N 3.31Å; G62-S64 PolarHBondContact O-N 2.75Å; S64-K66 PolarHBondContact O-N 2.93Å; S64-K66 PolarHBondContact OG-N 2.76Å | ||
| 65 | E | 36.3 | Very low | 45.3 | Very low | 162 Ų | 162 | 117.8 Ų | 117.8 | 76% | 0.757 | 65% | 0.652 | S | S | * | * | trans | -66.7 | 79.6 | 152.8 | -169.5 | -173.5 | 117.9 | 0 | 0 | 105.6 | K63 S67 | K63-E65 PolarHBondContact O-N 3.25Å; E65-S67 PolarHBondContact O-N 3.25Å | ||
| 66 | K | 41.4 | Very low | 46.7 | Very low | 179 Ų | 179 | 120 Ų | 120 | 78% | 0.778 | 65% | 0.65 | S | S | * | * | trans | -72 | 67.3 | 164.6 | -152.8 | 173.5 | -170.8 | 178.5 | 0 | 105.6 | S64 S68 | S64-K66 PolarHBondContact O-N 2.93Å; S64-K66 PolarHBondContact OG-N 2.76Å; K66-S68 PolarHBondContact O-N 3.22Å | ||
| 67 | S | 39.6 | Very low | 47.9 | Very low | 35 Ų | 35 | 121.4 Ų | 121.4 | 25% | 0.245 | 64% | 0.643 | C | S | . | * | trans | -44.8 | 115.6 | 149.7 | 41.3 | 0 | 0 | 0 | 0 | 104.2 | E65 | E65-S67 PolarHBondContact O-N 3.25Š| ||
| 68 | S | 37.2 | Very low | 49.6 | Very low | 49 Ų | 49 | 122.5 Ų | 122.5 | 34% | 0.343 | 63% | 0.63 | S | S | . | * | trans | -56.6 | 150.5 | -177.5 | 56.4 | 0 | 0 | 0 | 0 | 107.5 | K66 E70 D71 R72 | K66-S68 PolarHBondContact O-N 3.22Å; S68-E70 CarbonylContact O-C 3.57Å; S68-E70 PolarHBondContact O-N 2.94Å; S68-E70 WeakPolarHBondContact OG-CB 3.4Å; S68-D71 PolarHBondContact O-N 2.96Å; S68-D71 PolarHBondContact OG-N 3.42Å; S68-R72 PolarHBondContact O-N 3.29Å | ||
| 69 | P | 51.4 | Low | 50.7 | Low | 117 Ų | 117 | 117.2 Ų | 117.2 | 76% | 0.76 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -54.6 | -22.1 | 169.9 | 22.8 | -32.3 | 0 | 0 | 0 | 111.4 | G73 | P69-G73 PolarHBondContact O-N 2.89Å; P69-G73 VanDerWaalsContact O-N 3.09Å |
| 70 | E | 48.1 | Very low | 52.3 | Low | 140 Ų | 140 | 113.5 Ų | 113.5 | 65% | 0.654 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -60.4 | -59.9 | 164.6 | -112.3 | 155.2 | 117.7 | 0 | 0 | 114.2 | S68 R72 G73 E74 | S68-E70 CarbonylContact O-C 3.57Å; S68-E70 PolarHBondContact O-N 2.94Å; S68-E70 WeakPolarHBondContact OG-CB 3.4Å; E70-R72 PolarHBondContact O-N 3.41Å; E70-G73 CarbonylContact O-C 3.39Å; E70-G73 VanDerWaalsContact O-CA 3.26Å; E70-G73 WeakPolarHBondContact O-CA 3.37Å; E70-G73 PolarHBondContact O-N 2.83Å; E70-E74 WeakPolarHBondContact O-CG 3.26Å; E70-E74 PolarHBondContact O-N 2.95Å |
| 71 | D | 47.5 | Very low | 54.1 | Low | 47 Ų | 47 | 105.1 Ų | 105.1 | 25% | 0.251 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64 | -37 | -174.8 | 170.2 | 58.7 | 0 | 0 | 0 | 112.8 | S68 G73 E74 K75 | S68-D71 PolarHBondContact O-N 2.96Å; S68-D71 PolarHBondContact OG-N 3.42Å; D71-G73 VanDerWaalsContact C-N 3.34Å; D71-E74 PolarHBondContact O-N 3.11Å; D71-K75 WeakPolarHBondContact O-CB 3.26Å; D71-K75 WeakPolarHBondContact O-CG 3.3Å; D71-K75 PolarHBondContact O-N 3.32Å; D71-K75 WeakPolarHBondContact OD1-CE 3.45Å; D71-K75 IonicContact OD1-NZ 2.87Å; D71-K75 PolarHBondContact OD1-NZ 3.4Å; D71-K75 IonicContact OD2-NZ 2.69Å; D71-K75 PolarHBondContact OD2-NZ 2.96Å |
| 72 | R | 53.9 | Low | 56.3 | Low | 182 Ų | 182 | 102.4 Ų | 102.4 | 69% | 0.687 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.6 | -39.7 | 168.7 | -102.4 | -176 | 173 | -170 | -1.5 | 111.7 | S68 E70 Q76 | S68-R72 PolarHBondContact O-N 3.29Å; E70-R72 PolarHBondContact O-N 3.41Å; R72-Q76 WeakPolarHBondContact O-CB 3.46Å; R72-Q76 PolarHBondContact O-N 3.23Å |
| 73 | G | 59.5 | Low | 58.4 | Low | 23 Ų | 23 | 101.3 Ų | 101.3 | 24% | 0.237 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -64.5 | -39.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | P69 E70 D71 Q76 K77 | P69-G73 PolarHBondContact O-N 2.89Å; P69-G73 VanDerWaalsContact O-N 3.09Å; E70-G73 CarbonylContact O-C 3.39Å; E70-G73 VanDerWaalsContact O-CA 3.26Å; E70-G73 WeakPolarHBondContact O-CA 3.37Å; E70-G73 PolarHBondContact O-N 2.83Å; D71-G73 VanDerWaalsContact C-N 3.34Å; G73-Q76 PolarHBondContact O-N 2.82Å; G73-K77 WeakPolarHBondContact O-CB 3.34Å; G73-K77 WeakPolarHBondContact O-CG 3.49Å; G73-K77 PolarHBondContact O-N 3.04Å |
| 74 | E | 59.8 | Low | 61 | Low | 114 Ų | 114 | 95.6 Ų | 95.6 | 53% | 0.533 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.2 | -45 | 177.7 | -72.9 | -177.6 | 163.9 | 0 | 0 | 111.8 | E70 D71 Q76 K77 R78 | E70-E74 WeakPolarHBondContact O-CG 3.26Å; E70-E74 PolarHBondContact O-N 2.95Å; D71-E74 PolarHBondContact O-N 3.11Å; E74-Q76 VanDerWaalsContact C-N 3.28Å; E74-Q76 PolarHBondContact O-N 2.99Å; E74-K77 PolarHBondContact O-N 2.86Å; E74-R78 WeakPolarHBondContact O-CB 3.29Å; E74-R78 PolarHBondContact O-N 3.08Å |
| 75 | K | 60.6 | Low | 63.2 | Low | 125 Ų | 125 | 91.8 Ų | 91.8 | 54% | 0.543 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -58.4 | -40.9 | 172.3 | -75 | 163.5 | 179.2 | 156.6 | 0 | 111.3 | D71 A79 | D71-K75 WeakPolarHBondContact O-CB 3.26Å; D71-K75 WeakPolarHBondContact O-CG 3.3Å; D71-K75 PolarHBondContact O-N 3.32Å; D71-K75 WeakPolarHBondContact OD1-CE 3.45Å; D71-K75 IonicContact OD1-NZ 2.87Å; D71-K75 PolarHBondContact OD1-NZ 3.4Å; D71-K75 IonicContact OD2-NZ 2.69Å; D71-K75 PolarHBondContact OD2-NZ 2.96Å; K75-A79 WeakPolarHBondContact O-CB 3.45Å; K75-A79 PolarHBondContact O-N 2.79Å |
| 76 | Q | 64.9 | Low | 65.8 | Low | 152 Ų | 152 | 88.4 Ų | 88.4 | 71% | 0.71 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -72.2 | -37.4 | 176.3 | -170.9 | 159.1 | -7.1 | 0 | 0 | 113.3 | R72 G73 E74 A79 G80 | R72-Q76 WeakPolarHBondContact O-CB 3.46Å; R72-Q76 PolarHBondContact O-N 3.23Å; G73-Q76 PolarHBondContact O-N 2.82Å; E74-Q76 VanDerWaalsContact C-N 3.28Å; E74-Q76 PolarHBondContact O-N 2.99Å; Q76-A79 PolarHBondContact O-N 3.3Å; Q76-G80 PolarHBondContact O-N 2.83Å |
| 77 | K | 65.8 | Low | 68.2 | Low | 159 Ų | 159 | 82.7 Ų | 82.7 | 69% | 0.691 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62 | -45 | 172.4 | -76.7 | 165.8 | -177.5 | 175.4 | 0 | 111.6 | G73 E74 G80 A81 | G73-K77 WeakPolarHBondContact O-CB 3.34Å; G73-K77 WeakPolarHBondContact O-CG 3.49Å; G73-K77 PolarHBondContact O-N 3.04Å; E74-K77 PolarHBondContact O-N 2.86Å; K77-G80 PolarHBondContact O-N 2.74Å; K77-A81 PolarHBondContact O-N 3.29Å |
| 78 | R | 70.1 | Confident | 70.7 | Confident | 141 Ų | 141 | 81.1 Ų | 81.1 | 53% | 0.532 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -67.9 | -37.5 | 177.7 | -169.8 | 175.2 | -82.6 | 170.4 | -3.8 | 111.7 | E74 A81 N82 E120 | E74-R78 WeakPolarHBondContact O-CB 3.29Å; E74-R78 PolarHBondContact O-N 3.08Å; R78-A81 PolarHBondContact O-N 2.82Å; R78-N82 PolarHBondContact O-N 2.96Å; R78-N82 VanDerWaalsContact O-N 3.07Å; R78-N82 PolarHBondContact O-ND2 3.44Å; R78-E120 IonicContact CZ-OE2 3.63Å; R78-E120 IonicContact NE-OE2 3.81Å; R78-E120 IonicContact NH2-OE1 3.85Å; R78-E120 IonicContact NH2-OE2 2.67Å; R78-E120 PolarHBondContact NH2-OE2 2.99Å |
| 79 | A | 73.4 | Confident | 73.3 | Confident | 57 Ų | 57 | 80 Ų | 80 | 47% | 0.471 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.3 | -41.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | K75 Q76 N82 A83 | K75-A79 WeakPolarHBondContact O-CB 3.45Å; K75-A79 PolarHBondContact O-N 2.79Å; Q76-A79 PolarHBondContact O-N 3.3Å; A79-N82 PolarHBondContact O-N 2.88Å; A79-A83 PolarHBondContact O-N 3.35Å |
| 80 | G | 81.3 | Confident | 75.3 | Confident | 35 Ų | 35 | 79.3 Ų | 79.3 | 36% | 0.361 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -60.6 | -47.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q76 K77 N82 A83 T84 | Q76-G80 PolarHBondContact O-N 2.83Å; K77-G80 PolarHBondContact O-N 2.74Å; G80-N82 VanDerWaalsContact C-N 3.32Å; G80-N82 PolarHBondContact O-N 3.03Å; G80-A83 PolarHBondContact O-N 2.89Å; G80-A83 VanDerWaalsContact O-N 3.17Å; G80-T84 PolarHBondContact O-N 3.19Å; G80-T84 PolarHBondContact O-OG1 2.98Å; G80-T84 VanDerWaalsContact O-OG1 3.06Å |
| 81 | A | 82.8 | Confident | 77.4 | Confident | 13 Ų | 13 | 72.8 Ų | 72.8 | 11% | 0.107 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -59.1 | -41.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | K77 R78 T84 W85 L116 T119 | K77-A81 PolarHBondContact O-N 3.29Å; R78-A81 PolarHBondContact O-N 2.82Å; A81-T84 PolarHBondContact O-N 3.37Å; A81-W85 PolarHBondContact O-N 3.22Å; A81-L116 HydrophobicContact CB-CD1 4.22Å; A81-T119 HydrophobicContact CB-CG2 4.45Å |
| 82 | N | 85.5 | Confident | 79.6 | Confident | 74 Ų | 74 | 70.5 Ų | 70.5 | 40% | 0.396 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66.2 | -38.7 | 175.6 | -71.8 | -20.8 | 0 | 0 | 0 | 112.5 | R78 A79 G80 W85 N86 | R78-N82 PolarHBondContact O-N 2.96Å; R78-N82 VanDerWaalsContact O-N 3.07Å; R78-N82 PolarHBondContact O-ND2 3.44Å; A79-N82 PolarHBondContact O-N 2.88Å; G80-N82 VanDerWaalsContact C-N 3.32Å; G80-N82 PolarHBondContact O-N 3.03Å; N82-W85 PolarHBondContact O-N 3.14Å; N82-N86 VanDerWaalsContact O-CG 3.3Å; N82-N86 PolarHBondContact O-N 3.39Å; N82-N86 PolarHBondContact O-ND2 2.86Å |
| 83 | A | 89.4 | Confident | 81.5 | Confident | 61 Ų | 61 | 63 Ų | 63 | 50% | 0.504 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64 | -42.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | A79 G80 N86 S87 | A79-A83 PolarHBondContact O-N 3.35Å; G80-A83 PolarHBondContact O-N 2.89Å; G80-A83 VanDerWaalsContact O-N 3.17Å; A83-N86 PolarHBondContact O-N 2.85Å; A83-S87 PolarHBondContact O-N 3.19Å |
| 84 | T | 90.1 | Very high | 83.1 | Confident | 48 Ų | 48 | 62.9 Ų | 62.9 | 29% | 0.294 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60.3 | -44.8 | 173.3 | -54.6 | 0 | 0 | 0 | 0 | 111.7 | G80 A81 N86 S87 I88 G112 | G80-T84 PolarHBondContact O-N 3.19Å; G80-T84 PolarHBondContact O-OG1 2.98Å; G80-T84 VanDerWaalsContact O-OG1 3.06Å; A81-T84 PolarHBondContact O-N 3.37Å; T84-N86 PolarHBondContact O-N 3.47Å; T84-S87 WeakPolarHBondContact O-CB 2.94Å; T84-S87 PolarHBondContact O-N 2.81Å; T84-I88 HydrophobicContact CG2-CD1 4.05Å; T84-I88 WeakPolarHBondContact O-CG1 3.45Å; T84-I88 PolarHBondContact O-N 2.96Å; T84-G112 VanDerWaalsContact CG2-CA 3.43Å |
| 85 | W | 89.5 | Confident | 84.7 | Confident | 15 Ų | 15 | 58 Ų | 58 | 6% | 0.057 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.5 | -44 | 175.5 | 177.5 | -111.6 | 0 | 0 | 0 | 112.7 | A81 N82 S87 I88 H89 L116 F125 Y128 Q132 L133 | A81-W85 PolarHBondContact O-N 3.22Å; N82-W85 PolarHBondContact O-N 3.14Å; W85-S87 VanDerWaalsContact C-N 3.3Å; W85-S87 PolarHBondContact O-N 3.1Å; W85-I88 PolarHBondContact O-N 2.72Å; W85-H89 WeakPolarHBondContact O-CB 3.45Å; W85-H89 PolarHBondContact O-N 2.81Å; W85-L116 HydrophobicContact CB-CD2 4.44Å; W85-L116 HydrophobicContact CD2-CD2 4.32Å; W85-L116 HydrophobicContact CE3-CD2 3.46Å; W85-L116 VanDerWaalsContact CE3-CD2 3.46Å; W85-L116 HydrophobicContact CZ3-CD2 4.08Å; W85-F125 HydrophobicContact CZ3-CD2 4.33Å; W85-F125 AromaticContact CZ3-CE2 3.93Å; W85-F125 HydrophobicContact CZ3-CE2 3.93Å; W85-Y128 HydrophobicContact CZ2-CG 4.38Å; W85-Q132 HydrophobicContact CZ2-CB 4.49Å; W85-L133 HydrophobicContact CH2-CD1 3.43Å; W85-L133 VanDerWaalsContact CH2-CD1 3.43Å; W85-L133 HydrophobicContact CH2-CD2 4.13Å; W85-L133 HydrophobicContact CH2-CG 4.45Å; W85-L133 HydrophobicContact CZ2-CD1 3.24Å; W85-L133 HydrophobicContact CZ3-CD1 4.44Å |
| 86 | N | 90.9 | Very high | 86.2 | Confident | 90 Ų | 90 | 52 Ų | 52 | 48% | 0.481 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62.9 | -36.3 | 177.9 | -72.9 | -30.4 | 0 | 0 | 0 | 112.4 | N82 A83 T84 N90 | N82-N86 VanDerWaalsContact O-CG 3.3Å; N82-N86 PolarHBondContact O-N 3.39Å; N82-N86 PolarHBondContact O-ND2 2.86Å; A83-N86 PolarHBondContact O-N 2.85Å; T84-N86 PolarHBondContact O-N 3.47Å; N86-N90 WeakPolarHBondContact O-CB 3.22Å; N86-N90 PolarHBondContact O-N 2.91Å; N86-N90 PolarHBondContact O-ND2 3.19Å |
| 87 | S | 91.4 | Very high | 87.6 | Confident | 60 Ų | 60 | 48.5 Ų | 48.5 | 42% | 0.42 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.4 | -49 | 171.9 | 171.8 | 0 | 0 | 0 | 0 | 111.5 | A83 T84 W85 H89 N90 A91 | A83-S87 PolarHBondContact O-N 3.19Å; T84-S87 WeakPolarHBondContact O-CB 2.94Å; T84-S87 PolarHBondContact O-N 2.81Å; W85-S87 VanDerWaalsContact C-N 3.3Å; W85-S87 PolarHBondContact O-N 3.1Å; S87-H89 PolarHBondContact O-N 3.28Å; S87-N90 PolarHBondContact O-N 3.34Å; S87-A91 PolarHBondContact O-N 3.24Å |
| 88 | I | 92 | Very high | 88.8 | Confident | 2 Ų | 2 | 47.2 Ų | 47.2 | 1% | 0.01 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.9 | -46.4 | 177.2 | -64.5 | 159.1 | 0 | 0 | 0 | 111.6 | T84 W85 N90 A91 V92 L109 V113 L116 I175 F176 | T84-I88 HydrophobicContact CG2-CD1 4.05Å; T84-I88 WeakPolarHBondContact O-CG1 3.45Å; T84-I88 PolarHBondContact O-N 2.96Å; W85-I88 PolarHBondContact O-N 2.72Å; I88-N90 PolarHBondContact O-N 3Å; I88-A91 PolarHBondContact O-N 3.15Å; I88-V92 WeakPolarHBondContact O-CG2 3.26Å; I88-V92 PolarHBondContact O-N 2.89Å; I88-L109 HydrophobicContact CB-CD2 4.31Å; I88-L109 HydrophobicContact CG1-CD2 3.83Å; I88-V113 HydrophobicContact CD1-CG2 3.7Å; I88-V113 HydrophobicContact CG1-CG2 4.25Å; I88-V113 HydrophobicContact CG2-CG2 4.4Å; I88-L116 HydrophobicContact CD1-CD2 4.47Å; I88-I175 HydrophobicContact CG2-CG2 4.41Å; I88-F176 HydrophobicContact CG2-CE1 3.72Å; I88-F176 HydrophobicContact CG2-CZ 3.8Å |
| 89 | H | 91.9 | Very high | 89.6 | Confident | 24 Ų | 24 | 46.2 Ų | 46.2 | 11% | 0.111 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -56.9 | -48.8 | 176.1 | 172.3 | -76.4 | 0 | 0 | 0 | 111.1 | W85 S87 V92 I93 L133 K136 | W85-H89 WeakPolarHBondContact O-CB 3.45Å; W85-H89 PolarHBondContact O-N 2.81Å; S87-H89 PolarHBondContact O-N 3.28Å; H89-V92 PolarHBondContact O-N 2.99Å; H89-I93 VanDerWaalsContact O-CG1 3.32Å; H89-I93 WeakPolarHBondContact O-CG1 3.4Å; H89-I93 PolarHBondContact O-N 3.14Å; H89-L133 HydrophobicContact CB-CD1 4.28Å; H89-K136 PolarHBondContact NE2-NZ 3.18Å |
| 90 | N | 92.3 | Very high | 90 | Very high | 103 Ų | 103 | 47 Ų | 47 | 55% | 0.551 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -65.6 | -40.8 | -178.3 | -70.8 | -14.8 | 0 | 0 | 0 | 112.5 | N86 S87 I88 I93 A94 | N86-N90 WeakPolarHBondContact O-CB 3.22Å; N86-N90 PolarHBondContact O-N 2.91Å; N86-N90 PolarHBondContact O-ND2 3.19Å; S87-N90 PolarHBondContact O-N 3.34Å; I88-N90 PolarHBondContact O-N 3Å; N90-I93 PolarHBondContact O-N 2.93Å; N90-A94 WeakPolarHBondContact O-CB 3.46Å; N90-A94 PolarHBondContact O-N 2.7Å |
| 91 | A | 92.7 | Very high | 90.2 | Very high | 3 Ų | 3 | 47 Ų | 47 | 3% | 0.025 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.5 | -44.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | S87 I88 I93 A94 V95 L101 L109 | S87-A91 PolarHBondContact O-N 3.24Å; I88-A91 PolarHBondContact O-N 3.15Å; A91-I93 PolarHBondContact O-N 3.29Å; A91-A94 WeakPolarHBondContact O-CB 3.36Å; A91-A94 PolarHBondContact O-N 3.01Å; A91-V95 WeakPolarHBondContact O-CG2 3.31Å; A91-V95 PolarHBondContact O-N 3.5Å; A91-L101 HydrophobicContact CB-CD2 3.94Å; A91-L109 HydrophobicContact CB-CD1 3.55Å; A91-L109 HydrophobicContact CB-CD2 3.89Å; A91-L109 HydrophobicContact CB-CG 4.36Å |
| 92 | V | 93.7 | Very high | 90.3 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.2 | -42.6 | 176.7 | 169.3 | 0 | 0 | 0 | 0 | 111.6 | I88 H89 A94 V95 F96 L133 L172 I175 F176 | I88-V92 WeakPolarHBondContact O-CG2 3.26Å; I88-V92 PolarHBondContact O-N 2.89Å; H89-V92 PolarHBondContact O-N 2.99Å; V92-A94 VanDerWaalsContact C-N 3.29Å; V92-A94 PolarHBondContact O-N 2.68Å; V92-V95 WeakPolarHBondContact O-CB 3.11Å; V92-V95 PolarHBondContact O-N 3.49Å; V92-F96 HydrophobicContact CG1-CD2 3.89Å; V92-F96 HydrophobicContact CG1-CE2 3.84Å; V92-F96 WeakPolarHBondContact O-CD2 3.26Å; V92-F96 PolarHBondContact O-N 3.1Å; V92-L133 HydrophobicContact CB-CD2 4.01Å; V92-L133 HydrophobicContact CB-CG 4.35Å; V92-L133 HydrophobicContact CG1-CB 4.27Å; V92-L133 HydrophobicContact CG1-CD2 4Å; V92-L133 HydrophobicContact CG1-CG 4.12Å; V92-L133 HydrophobicContact CG2-CD2 3.9Å; V92-L172 HydrophobicContact CG1-CD2 3.67Å; V92-L172 HydrophobicContact CG2-CD2 4.09Å; V92-I175 HydrophobicContact CG2-CD1 3.92Å; V92-F176 HydrophobicContact CG2-CE2 4.03Å; V92-F176 HydrophobicContact CG2-CZ 3.99Å |
| 93 | I | 93.6 | Very high | 89.9 | Confident | 23 Ų | 23 | 53.4 Ų | 53.4 | 12% | 0.118 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64 | -35 | 174.8 | -64.6 | -60.4 | 0 | 0 | 0 | 111.5 | H89 N90 A91 F96 Q97 K136 I140 | H89-I93 VanDerWaalsContact O-CG1 3.32Å; H89-I93 WeakPolarHBondContact O-CG1 3.4Å; H89-I93 PolarHBondContact O-N 3.14Å; N90-I93 PolarHBondContact O-N 2.93Å; A91-I93 PolarHBondContact O-N 3.29Å; I93-F96 PolarHBondContact O-N 3.42Å; I93-Q97 VanDerWaalsContact O-CG 3.27Å; I93-Q97 WeakPolarHBondContact O-CG 3.29Å; I93-Q97 PolarHBondContact O-N 2.78Å; I93-K136 HydrophobicContact CD1-CB 3.73Å; I93-I140 HydrophobicContact CD1-CD1 4.28Å; I93-I140 HydrophobicContact CG2-CD1 3.96Å |
| 94 | A | 93 | Very high | 89.7 | Confident | 21 Ų | 21 | 56.7 Ų | 56.7 | 17% | 0.174 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.9 | -44.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | N90 A91 V92 F96 Q97 K98 K99 | N90-A94 WeakPolarHBondContact O-CB 3.46Å; N90-A94 PolarHBondContact O-N 2.7Å; A91-A94 WeakPolarHBondContact O-CB 3.36Å; A91-A94 PolarHBondContact O-N 3.01Å; V92-A94 VanDerWaalsContact C-N 3.29Å; V92-A94 PolarHBondContact O-N 2.68Å; A94-F96 PolarHBondContact O-N 2.83Å; A94-Q97 CarbonylContact O-C 3.57Å; A94-Q97 WeakPolarHBondContact O-CA 3.22Å; A94-Q97 WeakPolarHBondContact O-CB 3.45Å; A94-Q97 PolarHBondContact O-N 2.93Å; A94-K98 PolarHBondContact O-N 3.21Å; A94-K99 HydrophobicContact CB-CB 4.08Å; A94-K99 HydrophobicContact CB-CD 4.34Å; A94-K99 WeakPolarHBondContact O-CB 3.34Å; A94-K99 PolarHBondContact O-N 3.45Å |
| 95 | V | 93.7 | Very high | 89.7 | Confident | 11 Ų | 11 | 57.1 Ų | 57.1 | 7% | 0.067 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -55.8 | -52 | 173.2 | 172 | 0 | 0 | 0 | 0 | 110.8 | A91 V92 Q97 K98 L101 F163 V168 M171 | A91-V95 WeakPolarHBondContact O-CG2 3.31Å; A91-V95 PolarHBondContact O-N 3.5Å; V92-V95 WeakPolarHBondContact O-CB 3.11Å; V92-V95 PolarHBondContact O-N 3.49Å; V95-Q97 PolarHBondContact O-N 2.66Å; V95-Q97 VanDerWaalsContact O-N 3.09Å; V95-K98 PolarHBondContact O-N 2.92Å; V95-L101 HydrophobicContact CG2-CD2 3.93Å; V95-L101 HydrophobicContact CG2-CG 4.17Å; V95-F163 WeakPolarHBondContact O-CZ 3.38Å; V95-V168 HydrophobicContact CG1-CB 4.28Å; V95-V168 HydrophobicContact CG1-CG1 4.15Å; V95-V168 HydrophobicContact CG1-CG2 4.22Å; V95-M171 HydrophobicContact CG1-CB 3.84Å; V95-M171 HydrophobicContact CG1-CG 4.35Å; V95-M171 HydrophobicContact CG2-CB 4.27Å |
| 96 | F | 93.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.1 | -23 | 175.8 | -84 | -82.1 | 0 | 0 | 0 | 114 | V92 I93 A94 K98 L134 G137 M138 L141 K144 F164 V168 L172 | V92-F96 HydrophobicContact CG1-CD2 3.89Å; V92-F96 HydrophobicContact CG1-CE2 3.84Å; V92-F96 WeakPolarHBondContact O-CD2 3.26Å; V92-F96 PolarHBondContact O-N 3.1Å; I93-F96 PolarHBondContact O-N 3.42Å; A94-F96 PolarHBondContact O-N 2.83Å; F96-K98 VanDerWaalsContact C-N 3.34Å; F96-L134 HydrophobicContact CZ-CD2 4.32Å; F96-G137 VanDerWaalsContact CD1-C 3.4Å; F96-G137 VanDerWaalsContact CD1-CA 3.44Å; F96-G137 VanDerWaalsContact CD1-O 3.26Å; F96-G137 WeakPolarHBondContact CD1-O 3.27Å; F96-G137 VanDerWaalsContact CE1-C 3.45Å; F96-G137 VanDerWaalsContact CG-CA 3.44Å; F96-M138 HydrophobicContact CE1-CE 4.46Å; F96-M138 HydrophobicContact CE1-SD 4.27Å; F96-M138 HydrophobicContact CZ-CE 4.46Å; F96-L141 HydrophobicContact CD1-CD1 3.84Å; F96-L141 HydrophobicContact CD1-CD2 4.35Å; F96-L141 HydrophobicContact CD1-CG 3.88Å; F96-L141 HydrophobicContact CE1-CD1 3.81Å; F96-L141 HydrophobicContact CE1-CG 4.29Å; F96-K144 PolarHBondContact O-NZ 3.14Å; F96-K144 VanDerWaalsContact O-NZ 3.15Å; F96-F164 HydrophobicContact CE1-CD2 4.36Å; F96-F164 HydrophobicContact CE1-CE2 4.43Å; F96-V168 HydrophobicContact CD1-CG1 3.84Å; F96-V168 HydrophobicContact CD2-CG1 4.07Å; F96-V168 HydrophobicContact CE1-CG1 3.63Å; F96-V168 HydrophobicContact CE2-CG1 3.84Å; F96-V168 HydrophobicContact CG-CG1 4.07Å; F96-V168 HydrophobicContact CZ-CG1 3.62Å; F96-L172 HydrophobicContact CE2-CD1 4.17Å; F96-L172 HydrophobicContact CE2-CD2 4.49Å; F96-L172 HydrophobicContact CZ-CD1 4.12Å |
| 97 | Q | 92.6 | Very high | 89.6 | Confident | 79 Ų | 79 | 62.1 Ų | 62.1 | 37% | 0.369 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.2 | 5.5 | 175.8 | -72.6 | 177 | 9.7 | 0 | 0 | 114.5 | I93 A94 V95 K99 I140 | I93-Q97 VanDerWaalsContact O-CG 3.27Å; I93-Q97 WeakPolarHBondContact O-CG 3.29Å; I93-Q97 PolarHBondContact O-N 2.78Å; A94-Q97 CarbonylContact O-C 3.57Å; A94-Q97 WeakPolarHBondContact O-CA 3.22Å; A94-Q97 WeakPolarHBondContact O-CB 3.45Å; A94-Q97 PolarHBondContact O-N 2.93Å; V95-Q97 PolarHBondContact O-N 2.66Å; V95-Q97 VanDerWaalsContact O-N 3.09Å; Q97-K99 VanDerWaalsContact C-N 3.25Å; Q97-K99 HydrophobicContact CB-CD 4.26Å; Q97-K99 HydrophobicContact CB-CG 4.31Å; Q97-I140 HydrophobicContact CG-CD1 4.45Å |
| 98 | K | 91 | Very high | 89.6 | Confident | 132 Ų | 132 | 63.5 Ų | 63.5 | 57% | 0.574 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.4 | 26.1 | -169.9 | -74 | -172.9 | 170.5 | -172.2 | 0 | 113.3 | A94 V95 F96 F163 | A94-K98 PolarHBondContact O-N 3.21Å; V95-K98 PolarHBondContact O-N 2.92Å; F96-K98 VanDerWaalsContact C-N 3.34Å; K98-F163 HydrophobicContact CB-CE2 4.39Å; K98-F163 HydrophobicContact CB-CZ 4.2Å; K98-F163 HydrophobicContact CD-CD2 4.22Å; K98-F163 HydrophobicContact CD-CE1 4.47Å; K98-F163 HydrophobicContact CD-CE2 4.25Å; K98-F163 HydrophobicContact CD-CG 4.39Å; K98-F163 HydrophobicContact CD-CZ 4.35Å; K98-F163 HydrophobicContact CG-CD1 4.16Å; K98-F163 HydrophobicContact CG-CD2 3.85Å; K98-F163 HydrophobicContact CG-CE1 3.67Å; K98-F163 HydrophobicContact CG-CE2 3.38Å; K98-F163 HydrophobicContact CG-CG 4.24Å; K98-F163 HydrophobicContact CG-CZ 3.26Å |
| 99 | K | 87.8 | Confident | 89.6 | Confident | 120 Ų | 120 | 63.5 Ų | 63.5 | 52% | 0.522 | 35% | 0.345 | S | S | . | . | P | Polyproline II helix | trans | -95.1 | 130.6 | 170.5 | -62.9 | 169.7 | 177.5 | 166.7 | 0 | 108.8 | A94 Q97 | A94-K99 HydrophobicContact CB-CB 4.08Å; A94-K99 HydrophobicContact CB-CD 4.34Å; A94-K99 WeakPolarHBondContact O-CB 3.34Å; A94-K99 PolarHBondContact O-N 3.45Å; Q97-K99 VanDerWaalsContact C-N 3.25Å; Q97-K99 HydrophobicContact CB-CD 4.26Å; Q97-K99 HydrophobicContact CB-CG 4.31Å |
| 100 | G | 81.7 | Confident | 89.7 | Confident | 72 Ų | 72 | 63.6 Ų | 63.6 | 74% | 0.742 | 35% | 0.346 | S | S | * | . | P | Polyproline II helix | trans | -66.3 | 156.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 101 | L | 86.4 | Confident | 89.6 | Confident | 36 Ų | 36 | 60.8 Ų | 60.8 | 19% | 0.188 | 33% | 0.329 | C | S | . | . | P | Polyproline II helix | trans | -80.5 | 154.7 | 165.3 | -59.6 | -172.5 | 0 | 0 | 0 | 109.8 | A91 V95 E105 L106 L109 M171 I175 | A91-L101 HydrophobicContact CB-CD2 3.94Å; V95-L101 HydrophobicContact CG2-CD2 3.93Å; V95-L101 HydrophobicContact CG2-CG 4.17Å; L101-E105 WeakPolarHBondContact CA-OE2 3.23Å; L101-E105 HydrophobicContact CB-CB 4.3Å; L101-E105 WeakPolarHBondContact CB-OE2 3.24Å; L101-L106 HydrophobicContact CD1-CB 4.47Å; L101-L106 HydrophobicContact CD1-CD1 4.49Å; L101-L109 HydrophobicContact CD1-CD1 3.81Å; L101-M171 HydrophobicContact CD1-CE 3.43Å; L101-M171 VanDerWaalsContact CD1-CE 3.43Å; L101-M171 HydrophobicContact CG-CE 3.9Å; L101-I175 HydrophobicContact CD1-CD1 4.22Å; L101-I175 HydrophobicContact CD1-CG1 4.44Å |
| 102 | A | 83.5 | Confident | 89.5 | Confident | 67 Ų | 67 | 61 Ų | 61 | 55% | 0.554 | 33% | 0.333 | S | S | * | . | P | Polyproline II helix | trans | -74.6 | 158.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | N104 E105 | A102-N104 PolarHBondContact O-N 3.11Å; A102-E105 HydrophobicContact CB-CB 4.28Å; A102-E105 PolarHBondContact N-OE2 3.45Å; A102-E105 WeakPolarHBondContact O-CB 3.05Å; A102-E105 PolarHBondContact O-N 3.26Å |
| 103 | D | 77.8 | Confident | 89.3 | Confident | 155 Ų | 155 | 61 Ų | 61 | 83% | 0.829 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | 134.9 | 173.8 | -63.7 | -44.8 | 0 | 0 | 0 | 110.7 | E105 | D103-E105 PolarHBondContact O-N 3.39Å; D103-E105 VanDerWaalsContact O-N 3.14Å |
| 104 | N | 84.3 | Confident | 89.2 | Confident | 129 Ų | 129 | 64.6 Ų | 64.6 | 69% | 0.69 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.3 | -1.9 | -173.8 | -50.1 | -59 | 0 | 0 | 0 | 116.7 | A102 L106 Y107 T108 | A102-N104 PolarHBondContact O-N 3.11Å; N104-L106 VanDerWaalsContact C-N 3.35Å; N104-L106 PolarHBondContact O-N 2.76Å; N104-Y107 PolarHBondContact O-N 3.41Å; N104-T108 PolarHBondContact O-N 2.9Å; N104-T108 PolarHBondContact O-OG1 3.32Å; N104-T108 VanDerWaalsContact O-OG1 3.04Å |
| 105 | E | 90.1 | Very high | 88.9 | Confident | 57 Ų | 57 | 68.7 Ų | 68.7 | 27% | 0.266 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63 | -43.1 | 174.7 | -170.4 | -179.9 | -179.7 | 0 | 0 | 110.7 | L101 A102 D103 Y107 T108 L109 | L101-E105 WeakPolarHBondContact CA-OE2 3.23Å; L101-E105 HydrophobicContact CB-CB 4.3Å; L101-E105 WeakPolarHBondContact CB-OE2 3.24Å; A102-E105 HydrophobicContact CB-CB 4.28Å; A102-E105 PolarHBondContact N-OE2 3.45Å; A102-E105 WeakPolarHBondContact O-CB 3.05Å; A102-E105 PolarHBondContact O-N 3.26Å; D103-E105 PolarHBondContact O-N 3.39Å; D103-E105 VanDerWaalsContact O-N 3.14Å; E105-Y107 VanDerWaalsContact C-N 3.28Å; E105-Y107 PolarHBondContact O-N 2.94Å; E105-T108 WeakPolarHBondContact O-CB 3.49Å; E105-T108 PolarHBondContact O-N 3.13Å; E105-L109 HydrophobicContact CG-CD1 3.99Å; E105-L109 HydrophobicContact CG-CG 4.2Å; E105-L109 WeakPolarHBondContact O-CB 3.32Å; E105-L109 VanDerWaalsContact O-CG 3.28Å; E105-L109 WeakPolarHBondContact O-CG 3.28Å; E105-L109 PolarHBondContact O-N 2.95Å |
| 106 | L | 90.7 | Very high | 88.6 | Confident | 58 Ų | 58 | 68.4 Ų | 68.4 | 30% | 0.304 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -57.5 | -37 | 177.6 | -177.9 | 62.8 | 0 | 0 | 0 | 113.2 | L101 N104 N110 M171 A174 I175 | L101-L106 HydrophobicContact CD1-CB 4.47Å; L101-L106 HydrophobicContact CD1-CD1 4.49Å; N104-L106 VanDerWaalsContact C-N 3.35Å; N104-L106 PolarHBondContact O-N 2.76Å; L106-N110 WeakPolarHBondContact O-CB 3.4Å; L106-N110 PolarHBondContact O-N 2.71Å; L106-N110 PolarHBondContact O-ND2 2.99Å; L106-M171 HydrophobicContact CD1-CE 4.43Å; L106-A174 HydrophobicContact CD1-CB 4.08Å; L106-A174 HydrophobicContact CD2-CB 4.25Å; L106-I175 HydrophobicContact CD1-CB 4.46Å; L106-I175 HydrophobicContact CD1-CG1 3.66Å |
| 107 | Y | 89.6 | Confident | 88.4 | Confident | 152 Ų | 152 | 70.2 Ų | 70.2 | 60% | 0.596 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -67.6 | -47.1 | 174.8 | 177.7 | -96.9 | 0 | 0 | 0 | 110.8 | N104 E105 L109 N110 E111 | N104-Y107 PolarHBondContact O-N 3.41Å; E105-Y107 VanDerWaalsContact C-N 3.28Å; E105-Y107 PolarHBondContact O-N 2.94Å; Y107-L109 VanDerWaalsContact C-N 3.29Å; Y107-L109 PolarHBondContact O-N 3.18Å; Y107-N110 WeakPolarHBondContact O-CB 3.5Å; Y107-N110 PolarHBondContact O-N 2.97Å; Y107-N110 VanDerWaalsContact O-N 3.17Å; Y107-E111 HydrophobicContact CD1-CG 4.24Å; Y107-E111 HydrophobicContact CE1-CG 3.77Å; Y107-E111 HydrophobicContact CE2-CG 4.41Å; Y107-E111 PolarHBondContact O-N 3.4Å |
| 108 | T | 91.3 | Very high | 88.1 | Confident | 89 Ų | 89 | 74.1 Ų | 74.1 | 55% | 0.546 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -59.8 | -39.8 | 178.3 | -53.1 | 0 | 0 | 0 | 0 | 111.9 | N104 E105 G112 | N104-T108 PolarHBondContact O-N 2.9Å; N104-T108 PolarHBondContact O-OG1 3.32Å; N104-T108 VanDerWaalsContact O-OG1 3.04Å; E105-T108 WeakPolarHBondContact O-CB 3.49Å; E105-T108 PolarHBondContact O-N 3.13Å; T108-G112 PolarHBondContact O-N 3.03Å |
| 109 | L | 92 | Very high | 87.9 | Confident | 3 Ų | 3 | 70.6 Ų | 70.6 | 2% | 0.016 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -66.2 | -45 | 174.5 | -69.2 | 172.2 | 0 | 0 | 0 | 112.1 | I88 A91 L101 E105 Y107 E111 G112 V113 I175 | I88-L109 HydrophobicContact CB-CD2 4.31Å; I88-L109 HydrophobicContact CG1-CD2 3.83Å; A91-L109 HydrophobicContact CB-CD1 3.55Å; A91-L109 HydrophobicContact CB-CD2 3.89Å; A91-L109 HydrophobicContact CB-CG 4.36Å; L101-L109 HydrophobicContact CD1-CD1 3.81Å; E105-L109 HydrophobicContact CG-CD1 3.99Å; E105-L109 HydrophobicContact CG-CG 4.2Å; E105-L109 WeakPolarHBondContact O-CB 3.32Å; E105-L109 VanDerWaalsContact O-CG 3.28Å; E105-L109 WeakPolarHBondContact O-CG 3.28Å; E105-L109 PolarHBondContact O-N 2.95Å; Y107-L109 VanDerWaalsContact C-N 3.29Å; Y107-L109 PolarHBondContact O-N 3.18Å; L109-E111 VanDerWaalsContact C-N 3.35Å; L109-E111 PolarHBondContact O-N 2.99Å; L109-G112 PolarHBondContact O-N 3.38Å; L109-G112 VanDerWaalsContact O-N 3.14Å; L109-V113 WeakPolarHBondContact O-CG2 3.49Å; L109-V113 PolarHBondContact O-N 3Å; L109-I175 HydrophobicContact CB-CG2 4.34Å; L109-I175 HydrophobicContact CD1-CD1 4.34Å; L109-I175 HydrophobicContact CD1-CG1 4.2Å |
| 110 | N | 93.1 | Very high | 87.6 | Confident | 26 Ų | 26 | 71 Ų | 71 | 14% | 0.139 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 175.8 | -91 | -72.1 | 0 | 0 | 0 | 112.2 | L106 Y107 V113 R114 A174 I175 P178 | L106-N110 WeakPolarHBondContact O-CB 3.4Å; L106-N110 PolarHBondContact O-N 2.71Å; L106-N110 PolarHBondContact O-ND2 2.99Å; Y107-N110 WeakPolarHBondContact O-CB 3.5Å; Y107-N110 PolarHBondContact O-N 2.97Å; Y107-N110 VanDerWaalsContact O-N 3.17Å; N110-V113 PolarHBondContact O-N 2.94Å; N110-R114 PolarHBondContact O-N 2.85Å; N110-A174 PolarHBondContact ND2-O 3.48Å; N110-A174 PolarHBondContact OD1-O 3.48Å; N110-I175 PolarHBondContact OD1-O 2.99Å; N110-P178 HydrophobicContact CB-CG 4.46Å; N110-P178 WeakPolarHBondContact OD1-CD 3.15Å; N110-P178 WeakPolarHBondContact OD1-CG 3.38Å |
| 111 | E | 90.3 | Very high | 87.4 | Confident | 43 Ų | 43 | 68.7 Ų | 68.7 | 20% | 0.201 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -59.9 | -48.7 | 171 | -70.3 | -52.4 | 117.1 | 0 | 0 | 111 | Y107 L109 V113 R114 H115 | Y107-E111 HydrophobicContact CD1-CG 4.24Å; Y107-E111 HydrophobicContact CE1-CG 3.77Å; Y107-E111 HydrophobicContact CE2-CG 4.41Å; Y107-E111 PolarHBondContact O-N 3.4Å; L109-E111 VanDerWaalsContact C-N 3.35Å; L109-E111 PolarHBondContact O-N 2.99Å; E111-V113 PolarHBondContact O-N 3.09Å; E111-R114 PolarHBondContact O-N 3.07Å; E111-R114 VanDerWaalsContact O-N 3.13Å; E111-R114 IonicContact OE1-CZ 3.85Å; E111-R114 IonicContact OE1-NH1 2.74Å; E111-R114 PolarHBondContact OE1-NH1 3.4Å; E111-R114 IonicContact OE1-NH2 3.17Å; E111-R114 PolarHBondContact OE1-NH2 2.82Å; E111-R114 IonicContact OE2-CZ 2.74Å; E111-R114 IonicContact OE2-NH1 3.78Å; E111-R114 PolarHBondContact OE2-NH1 2.86Å; E111-H115 PolarHBondContact O-N 3.15Å; E111-H115 PolarHBondContact O-ND1 2.74Å; E111-H115 IonicContact OE2-CE1 2.95Å |
| 112 | G | 89.7 | Confident | 87.2 | Confident | 9 Ų | 9 | 67.1 Ų | 67.1 | 9% | 0.093 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -56.2 | -45.2 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | T84 T108 L109 H115 L116 | T84-G112 VanDerWaalsContact CG2-CA 3.43Å; T108-G112 PolarHBondContact O-N 3.03Å; L109-G112 PolarHBondContact O-N 3.38Å; L109-G112 VanDerWaalsContact O-N 3.14Å; G112-H115 PolarHBondContact O-N 3.47Å; G112-L116 WeakPolarHBondContact O-CB 3.33Å; G112-L116 PolarHBondContact O-N 3.46Å |
| 113 | V | 91.1 | Very high | 87.1 | Confident | 0 Ų | 0 | 67.9 Ų | 67.9 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.9 | -45.1 | 174.9 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | I88 L109 N110 E111 H115 L116 L117 I175 F176 P178 V179 | I88-V113 HydrophobicContact CD1-CG2 3.7Å; I88-V113 HydrophobicContact CG1-CG2 4.25Å; I88-V113 HydrophobicContact CG2-CG2 4.4Å; L109-V113 WeakPolarHBondContact O-CG2 3.49Å; L109-V113 PolarHBondContact O-N 3Å; N110-V113 PolarHBondContact O-N 2.94Å; E111-V113 PolarHBondContact O-N 3.09Å; V113-H115 VanDerWaalsContact C-N 3.3Å; V113-H115 PolarHBondContact O-N 3.48Å; V113-L116 PolarHBondContact O-N 3.3Å; V113-L117 HydrophobicContact CG1-CD1 4.05Å; V113-L117 HydrophobicContact CG1-CG 4.32Å; V113-L117 WeakPolarHBondContact O-CB 3.27Å; V113-L117 VanDerWaalsContact O-CG 3.31Å; V113-L117 WeakPolarHBondContact O-CG 3.33Å; V113-L117 PolarHBondContact O-N 3.25Å; V113-I175 HydrophobicContact CG2-CG2 4.46Å; V113-F176 HydrophobicContact CG1-CD1 4.19Å; V113-F176 HydrophobicContact CG2-CD1 3.79Å; V113-F176 HydrophobicContact CG2-CE1 3.8Å; V113-P178 HydrophobicContact CB-CG 4.3Å; V113-P178 HydrophobicContact CG1-CB 4.13Å; V113-P178 HydrophobicContact CG1-CG 4.08Å; V113-V179 HydrophobicContact CG1-CG2 3.75Å |
| 114 | R | 89.9 | Confident | 87.4 | Confident | 97 Ų | 97 | 65.9 Ų | 65.9 | 37% | 0.366 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -66.6 | -31.4 | 179.3 | -153.8 | -172.6 | -46.7 | 98.8 | 1.3 | 112.8 | N110 E111 K118 P178 | N110-R114 PolarHBondContact O-N 2.85Å; E111-R114 PolarHBondContact O-N 3.07Å; E111-R114 VanDerWaalsContact O-N 3.13Å; E111-R114 IonicContact OE1-CZ 3.85Å; E111-R114 IonicContact OE1-NH1 2.74Å; E111-R114 PolarHBondContact OE1-NH1 3.4Å; E111-R114 IonicContact OE1-NH2 3.17Å; E111-R114 PolarHBondContact OE1-NH2 2.82Å; E111-R114 IonicContact OE2-CZ 2.74Å; E111-R114 IonicContact OE2-NH1 3.78Å; E111-R114 PolarHBondContact OE2-NH1 2.86Å; R114-K118 WeakPolarHBondContact O-CG 3.25Å; R114-P178 HydrophobicContact CB-CB 4.14Å; R114-P178 HydrophobicContact CB-CG 4.45Å; R114-P178 HydrophobicContact CG-CB 4.25Å |
| 115 | H | 88.3 | Confident | 87.4 | Confident | 108 Ų | 108 | 59.8 Ų | 59.8 | 50% | 0.5 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -70.6 | -46.1 | 171.6 | -71.8 | 89.3 | 0 | 0 | 0 | 111.1 | E111 G112 V113 L117 K118 T119 | E111-H115 PolarHBondContact O-N 3.15Å; E111-H115 PolarHBondContact O-ND1 2.74Å; E111-H115 IonicContact OE2-CE1 2.95Å; G112-H115 PolarHBondContact O-N 3.47Å; V113-H115 VanDerWaalsContact C-N 3.3Å; V113-H115 PolarHBondContact O-N 3.48Å; H115-L117 VanDerWaalsContact C-N 3.34Å; H115-L117 PolarHBondContact O-N 2.95Å; H115-K118 WeakPolarHBondContact O-CB 3.46Å; H115-K118 PolarHBondContact O-N 3.04Å; H115-K118 VanDerWaalsContact O-N 3.1Å; H115-T119 PolarHBondContact O-N 2.73Å |
| 116 | L | 87.3 | Confident | 87 | Confident | 5 Ų | 5 | 58.4 Ų | 58.4 | 3% | 0.026 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60 | -42.3 | 179.5 | -170 | 68.3 | 0 | 0 | 0 | 112.3 | A81 W85 I88 G112 V113 K118 T119 L121 G122 F125 | A81-L116 HydrophobicContact CB-CD1 4.22Å; W85-L116 HydrophobicContact CB-CD2 4.44Å; W85-L116 HydrophobicContact CD2-CD2 4.32Å; W85-L116 HydrophobicContact CE3-CD2 3.46Å; W85-L116 VanDerWaalsContact CE3-CD2 3.46Å; W85-L116 HydrophobicContact CZ3-CD2 4.08Å; I88-L116 HydrophobicContact CD1-CD2 4.47Å; G112-L116 WeakPolarHBondContact O-CB 3.33Å; G112-L116 PolarHBondContact O-N 3.46Å; V113-L116 PolarHBondContact O-N 3.3Å; L116-K118 PolarHBondContact O-N 2.94Å; L116-T119 PolarHBondContact O-N 3.47Å; L116-T119 PolarHBondContact O-OG1 2.99Å; L116-L121 HydrophobicContact CD1-CB 3.78Å; L116-L121 HydrophobicContact CD1-CD2 3.94Å; L116-L121 HydrophobicContact CD1-CG 4.37Å; L116-L121 HydrophobicContact CG-CB 4.26Å; L116-G122 PolarHBondContact O-N 2.88Å; L116-F125 HydrophobicContact CD2-CD2 4.31Å |
| 117 | L | 87.2 | Confident | 86.8 | Confident | 38 Ų | 38 | 60.4 Ų | 60.4 | 20% | 0.199 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.5 | -24.2 | 176.4 | -73.8 | 173.1 | 0 | 0 | 0 | 114.3 | V113 H115 F125 P178 V179 | V113-L117 HydrophobicContact CG1-CD1 4.05Å; V113-L117 HydrophobicContact CG1-CG 4.32Å; V113-L117 WeakPolarHBondContact O-CB 3.27Å; V113-L117 VanDerWaalsContact O-CG 3.31Å; V113-L117 WeakPolarHBondContact O-CG 3.33Å; V113-L117 PolarHBondContact O-N 3.25Å; H115-L117 VanDerWaalsContact C-N 3.34Å; H115-L117 PolarHBondContact O-N 2.95Å; L117-F125 HydrophobicContact CD2-CB 4.23Å; L117-F125 HydrophobicContact CD2-CD1 4.43Å; L117-F125 HydrophobicContact CD2-CD2 4.31Å; L117-F125 HydrophobicContact CD2-CG 4.03Å; L117-P178 HydrophobicContact CD1-CB 4.16Å; L117-P178 VanDerWaalsContact CD1-O 3.24Å; L117-P178 WeakPolarHBondContact CD1-O 3.44Å; L117-V179 HydrophobicContact CD1-CG2 4.03Å; L117-V179 HydrophobicContact CD2-CG1 4.44Å; L117-V179 HydrophobicContact CD2-CG2 4.49Å |
| 118 | K | 86.9 | Confident | 86.7 | Confident | 161 Ų | 161 | 57 Ų | 57 | 70% | 0.7 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.9 | -11.4 | 175 | -67.2 | 171.8 | -178.8 | -178.5 | 0 | 113.1 | R114 H115 L116 | R114-K118 WeakPolarHBondContact O-CG 3.25Å; H115-K118 WeakPolarHBondContact O-CB 3.46Å; H115-K118 PolarHBondContact O-N 3.04Å; H115-K118 VanDerWaalsContact O-N 3.1Å; L116-K118 PolarHBondContact O-N 2.94Å |
| 119 | T | 87 | Confident | 86.4 | Confident | 57 Ų | 57 | 52.9 Ų | 52.9 | 35% | 0.35 | 26% | 0.258 | S | S | . | . | S | Bend | trans | -91.7 | 171.8 | 174.8 | 72.4 | 0 | 0 | 0 | 0 | 111.1 | A81 H115 L116 L121 G122 | A81-T119 HydrophobicContact CB-CG2 4.45Å; H115-T119 PolarHBondContact O-N 2.73Å; L116-T119 PolarHBondContact O-N 3.47Å; L116-T119 PolarHBondContact O-OG1 2.99Å; T119-L121 PolarHBondContact O-N 3.24Å; T119-L121 VanDerWaalsContact O-N 3.12Å; T119-L121 PolarHBondContact OG1-N 3.42Å; T119-G122 PolarHBondContact O-N 2.86Å |
| 120 | E | 82.4 | Confident | 86.2 | Confident | 129 Ų | 129 | 55.4 Ų | 55.4 | 60% | 0.603 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55 | -25.5 | 172.4 | -58.8 | 169.4 | 146.3 | 0 | 0 | 113.5 | R78 G122 S123 | R78-E120 IonicContact CZ-OE2 3.63Å; R78-E120 IonicContact NE-OE2 3.81Å; R78-E120 IonicContact NH2-OE1 3.85Å; R78-E120 IonicContact NH2-OE2 2.67Å; R78-E120 PolarHBondContact NH2-OE2 2.99Å; E120-G122 PolarHBondContact O-N 3.35Å; E120-S123 PolarHBondContact O-OG 3.23Å |
| 121 | L | 77.1 | Confident | 85.9 | Confident | 24 Ų | 24 | 58.5 Ų | 58.5 | 13% | 0.126 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -70.2 | -14.7 | 175.4 | -72.2 | 81.1 | 0 | 0 | 0 | 112.5 | L116 T119 S123 F124 F125 | L116-L121 HydrophobicContact CD1-CB 3.78Å; L116-L121 HydrophobicContact CD1-CD2 3.94Å; L116-L121 HydrophobicContact CD1-CG 4.37Å; L116-L121 HydrophobicContact CG-CB 4.26Å; T119-L121 PolarHBondContact O-N 3.24Å; T119-L121 VanDerWaalsContact O-N 3.12Å; T119-L121 PolarHBondContact OG1-N 3.42Å; L121-S123 VanDerWaalsContact C-N 3.29Å; L121-S123 PolarHBondContact O-N 2.84Å; L121-F124 PolarHBondContact O-N 3.4Å; L121-F125 PolarHBondContact O-N 2.79Å; L121-F125 VanDerWaalsContact O-N 3.07Å |
| 122 | G | 81.6 | Confident | 85.8 | Confident | 3 Ų | 3 | 59.3 Ų | 59.3 | 3% | 0.031 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.4 | -22.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | L116 T119 E120 K182 | L116-G122 PolarHBondContact O-N 2.88Å; T119-G122 PolarHBondContact O-N 2.86Å; E120-G122 PolarHBondContact O-N 3.35Å; G122-K182 PolarHBondContact O-NZ 2.95Å |
| 123 | S | 81.9 | Confident | 85.8 | Confident | 82 Ų | 82 | 58.9 Ų | 58.9 | 57% | 0.573 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -76.1 | -47.4 | 174.4 | 55.3 | 0 | 0 | 0 | 0 | 111.4 | E120 L121 F125 | E120-S123 PolarHBondContact O-OG 3.23Å; L121-S123 VanDerWaalsContact C-N 3.29Å; L121-S123 PolarHBondContact O-N 2.84Å; S123-F125 PolarHBondContact O-N 3.42Å |
| 124 | F | 83.7 | Confident | 85.8 | Confident | 114 Ų | 114 | 59 Ų | 59 | 50% | 0.5 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -78.9 | -1 | 178.4 | -58.3 | -77.1 | 0 | 0 | 0 | 113.8 | L121 S126 E127 Y128 | L121-F124 PolarHBondContact O-N 3.4Å; F124-S126 VanDerWaalsContact C-N 3.28Å; F124-S126 PolarHBondContact O-N 3.15Å; F124-E127 WeakPolarHBondContact O-CB 3.34Å; F124-E127 PolarHBondContact O-N 3.28Å; F124-Y128 HydrophobicContact CB-CD2 3.87Å; F124-Y128 HydrophobicContact CB-CE2 3.61Å; F124-Y128 WeakPolarHBondContact O-CD2 3.44Å; F124-Y128 PolarHBondContact O-N 2.9Å |
| 125 | F | 84.3 | Confident | 85.9 | Confident | 1 Ų | 1 | 57.1 Ų | 57.1 | 0% | 0.004 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -50.8 | -44.5 | -176.4 | 179.1 | -87.6 | 0 | 0 | 0 | 113.4 | W85 L116 L117 L121 S123 E127 Y128 L129 F176 V179 | W85-F125 HydrophobicContact CZ3-CD2 4.33Å; W85-F125 AromaticContact CZ3-CE2 3.93Å; W85-F125 HydrophobicContact CZ3-CE2 3.93Å; L116-F125 HydrophobicContact CD2-CD2 4.31Å; L117-F125 HydrophobicContact CD2-CB 4.23Å; L117-F125 HydrophobicContact CD2-CD1 4.43Å; L117-F125 HydrophobicContact CD2-CD2 4.31Å; L117-F125 HydrophobicContact CD2-CG 4.03Å; L121-F125 PolarHBondContact O-N 2.79Å; L121-F125 VanDerWaalsContact O-N 3.07Å; S123-F125 PolarHBondContact O-N 3.42Å; F125-E127 VanDerWaalsContact C-N 3.3Å; F125-E127 PolarHBondContact O-N 3.07Å; F125-Y128 PolarHBondContact O-N 3.39Å; F125-L129 HydrophobicContact CE1-CB 4.3Å; F125-L129 HydrophobicContact CE1-CD2 4.05Å; F125-L129 WeakPolarHBondContact O-CB 3.49Å; F125-L129 PolarHBondContact O-N 3.11Å; F125-F176 HydrophobicContact CE1-CD1 4.44Å; F125-F176 HydrophobicContact CE2-CD1 4.22Å; F125-F176 HydrophobicContact CE2-CE1 4.04Å; F125-F176 AromaticContact CZ-CD1 3.49Å; F125-F176 HydrophobicContact CZ-CD1 3.49Å; F125-F176 VanDerWaalsContact CZ-CD1 3.49Å; F125-F176 AromaticContact CZ-CE1 3.6Å; F125-F176 HydrophobicContact CZ-CE1 3.6Å; F125-F176 HydrophobicContact CZ-CG 4.22Å; F125-F176 HydrophobicContact CZ-CZ 4.4Å; F125-V179 HydrophobicContact CD1-CG1 3.79Å; F125-V179 HydrophobicContact CD1-CG2 4.27Å; F125-V179 HydrophobicContact CE1-CB 4.29Å; F125-V179 HydrophobicContact CE1-CG1 3.7Å; F125-V179 HydrophobicContact CE1-CG2 3.61Å; F125-V179 HydrophobicContact CZ-CG2 3.77Å |
| 126 | S | 81.8 | Confident | 86.1 | Confident | 27 Ų | 27 | 56.6 Ų | 56.6 | 19% | 0.189 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.3 | -31.4 | 179.9 | -56.9 | 0 | 0 | 0 | 0 | 112.7 | F124 Q130 | F124-S126 VanDerWaalsContact C-N 3.28Å; F124-S126 PolarHBondContact O-N 3.15Å; S126-Q130 VanDerWaalsContact O-CG 3.24Å; S126-Q130 WeakPolarHBondContact O-CG 3.22Å; S126-Q130 PolarHBondContact O-N 3.34Å; S126-Q130 PolarHBondContact O-NE2 2.97Å |
| 127 | E | 87 | Confident | 86.3 | Confident | 101 Ų | 101 | 56.3 Ų | 56.3 | 47% | 0.472 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -73.4 | -43.9 | 174.9 | -173.4 | -173.3 | 160.2 | 0 | 0 | 110.8 | F124 F125 L129 Q130 N131 | F124-E127 WeakPolarHBondContact O-CB 3.34Å; F124-E127 PolarHBondContact O-N 3.28Å; F125-E127 VanDerWaalsContact C-N 3.3Å; F125-E127 PolarHBondContact O-N 3.07Å; E127-L129 VanDerWaalsContact C-N 3.35Å; E127-L129 PolarHBondContact O-N 3.39Å; E127-Q130 PolarHBondContact O-N 3.14Å; E127-N131 VanDerWaalsContact CG-ND2 3.29Å; E127-N131 WeakPolarHBondContact CG-ND2 3.37Å; E127-N131 WeakPolarHBondContact O-CB 3.38Å; E127-N131 PolarHBondContact O-N 3.19Å; E127-N131 PolarHBondContact OE1-ND2 3.48Å |
| 128 | Y | 86.1 | Confident | 86.6 | Confident | 79 Ų | 79 | 54.5 Ų | 54.5 | 31% | 0.31 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -63.3 | -38.8 | 176.3 | -72.6 | -50.8 | 0 | 0 | 0 | 113 | W85 F124 F125 Q130 Q132 L133 | W85-Y128 HydrophobicContact CZ2-CG 4.38Å; F124-Y128 HydrophobicContact CB-CD2 3.87Å; F124-Y128 HydrophobicContact CB-CE2 3.61Å; F124-Y128 WeakPolarHBondContact O-CD2 3.44Å; F124-Y128 PolarHBondContact O-N 2.9Å; F125-Y128 PolarHBondContact O-N 3.39Å; Y128-Q130 VanDerWaalsContact C-N 3.34Å; Y128-Q130 PolarHBondContact O-N 3.02Å; Y128-Q132 HydrophobicContact CD1-CG 4.36Å; Y128-Q132 VanDerWaalsContact CD1-NE2 3.34Å; Y128-Q132 WeakPolarHBondContact O-CB 3.38Å; Y128-Q132 PolarHBondContact O-N 3.39Å; Y128-L133 PolarHBondContact O-N 2.98Å |
| 129 | L | 86.2 | Confident | 86.8 | Confident | 4 Ų | 4 | 49 Ų | 49 | 2% | 0.021 | 25% | 0.251 | C | S | . | . | I | π-helix | trans | -60.5 | -42.4 | 173.7 | 179.6 | 61.2 | 0 | 0 | 0 | 111.6 | F125 E127 L133 L134 F176 V186 L189 | F125-L129 HydrophobicContact CE1-CB 4.3Å; F125-L129 HydrophobicContact CE1-CD2 4.05Å; F125-L129 WeakPolarHBondContact O-CB 3.49Å; F125-L129 PolarHBondContact O-N 3.11Å; E127-L129 VanDerWaalsContact C-N 3.35Å; E127-L129 PolarHBondContact O-N 3.39Å; L129-L133 HydrophobicContact CD1-CB 4.15Å; L129-L133 HydrophobicContact CD1-CD2 3.98Å; L129-L133 WeakPolarHBondContact O-CB 3.32Å; L129-L133 PolarHBondContact O-N 3.29Å; L129-L134 HydrophobicContact CD1-CG 4.47Å; L129-L134 HydrophobicContact CG-CD1 4.32Å; L129-L134 HydrophobicContact CG-CG 4.48Å; L129-L134 WeakPolarHBondContact O-CG 3.37Å; L129-L134 PolarHBondContact O-N 3.5Å; L129-F176 HydrophobicContact CD1-CD2 4.06Å; L129-F176 HydrophobicContact CD1-CE2 3.58Å; L129-F176 HydrophobicContact CD1-CZ 4.04Å; L129-V186 HydrophobicContact CD2-CG1 4.3Å; L129-V186 HydrophobicContact CD2-CG2 4Å; L129-L189 HydrophobicContact CB-CD2 4.36Å; L129-L189 HydrophobicContact CD2-CD2 3.69Å; L129-L189 HydrophobicContact CG-CD2 3.85Å |
| 130 | Q | 87.4 | Confident | 87.1 | Confident | 55 Ų | 55 | 48.4 Ų | 48.4 | 26% | 0.257 | 25% | 0.245 | S | C | . | . | I | π-helix | trans | -65.6 | -69.6 | 174.5 | -68.5 | 174.8 | 73.7 | 0 | 0 | 110.9 | S126 E127 Y128 Q132 L134 T135 L189 | S126-Q130 VanDerWaalsContact O-CG 3.24Å; S126-Q130 WeakPolarHBondContact O-CG 3.22Å; S126-Q130 PolarHBondContact O-N 3.34Å; S126-Q130 PolarHBondContact O-NE2 2.97Å; E127-Q130 PolarHBondContact O-N 3.14Å; Y128-Q130 VanDerWaalsContact C-N 3.34Å; Y128-Q130 PolarHBondContact O-N 3.02Å; Q130-Q132 PolarHBondContact O-N 3.22Å; Q130-L134 PolarHBondContact O-N 3.37Å; Q130-T135 PolarHBondContact O-N 3.33Å; Q130-T135 PolarHBondContact O-OG1 3.04Å; Q130-L189 HydrophobicContact CG-CD1 3.38Å; Q130-L189 HydrophobicContact CG-CD2 3.43Å; Q130-L189 VanDerWaalsContact CG-CD2 3.43Å; Q130-L189 HydrophobicContact CG-CG 3.67Å |
| 131 | N | 87.1 | Confident | 87.5 | Confident | 91 Ų | 91 | 42.3 Ų | 42.3 | 49% | 0.487 | 22% | 0.216 | S | C | . | . | I | π-helix | trans | -71.3 | -26.7 | -163.6 | -67.2 | -15.3 | 0 | 0 | 0 | 113.4 | E127 | E127-N131 VanDerWaalsContact CG-ND2 3.29Å; E127-N131 WeakPolarHBondContact CG-ND2 3.37Å; E127-N131 WeakPolarHBondContact O-CB 3.38Å; E127-N131 PolarHBondContact O-N 3.19Å; E127-N131 PolarHBondContact OE1-ND2 3.48Å |
| 132 | Q | 88.3 | Confident | 88.2 | Confident | 61 Ų | 61 | 44.3 Ų | 44.3 | 29% | 0.285 | 22% | 0.222 | S | C | . | . | I | π-helix | trans | -105.4 | -47.3 | -179.2 | -56.9 | -168 | 11.2 | 0 | 0 | 113.5 | W85 Y128 Q130 K136 | W85-Q132 HydrophobicContact CZ2-CB 4.49Å; Y128-Q132 HydrophobicContact CD1-CG 4.36Å; Y128-Q132 VanDerWaalsContact CD1-NE2 3.34Å; Y128-Q132 WeakPolarHBondContact O-CB 3.38Å; Y128-Q132 PolarHBondContact O-N 3.39Å; Q130-Q132 PolarHBondContact O-N 3.22Å; Q132-K136 WeakPolarHBondContact O-CB 3.38Å; Q132-K136 WeakPolarHBondContact O-CD 3.38Å; Q132-K136 WeakPolarHBondContact O-CG 3.4Å |
| 133 | L | 89.9 | Confident | 88.7 | Confident | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | I | π-helix | trans | -87 | -57.6 | -172.5 | -84.8 | 63.8 | 0 | 0 | 0 | 111.3 | W85 H89 V92 Y128 L129 K136 G137 F176 | W85-L133 HydrophobicContact CH2-CD1 3.43Å; W85-L133 VanDerWaalsContact CH2-CD1 3.43Å; W85-L133 HydrophobicContact CH2-CD2 4.13Å; W85-L133 HydrophobicContact CH2-CG 4.45Å; W85-L133 HydrophobicContact CZ2-CD1 3.24Å; W85-L133 HydrophobicContact CZ3-CD1 4.44Å; H89-L133 HydrophobicContact CB-CD1 4.28Å; V92-L133 HydrophobicContact CB-CD2 4.01Å; V92-L133 HydrophobicContact CB-CG 4.35Å; V92-L133 HydrophobicContact CG1-CB 4.27Å; V92-L133 HydrophobicContact CG1-CD2 4Å; V92-L133 HydrophobicContact CG1-CG 4.12Å; V92-L133 HydrophobicContact CG2-CD2 3.9Å; Y128-L133 PolarHBondContact O-N 2.98Å; L129-L133 HydrophobicContact CD1-CB 4.15Å; L129-L133 HydrophobicContact CD1-CD2 3.98Å; L129-L133 WeakPolarHBondContact O-CB 3.32Å; L129-L133 PolarHBondContact O-N 3.29Å; L133-K136 PolarHBondContact O-N 2.93Å; L133-G137 PolarHBondContact O-N 2.98Å; L133-F176 HydrophobicContact CD2-CE2 4.02Å; L133-F176 HydrophobicContact CD2-CZ 3.54Å |
| 134 | L | 91.1 | Very high | 89.1 | Confident | 1 Ų | 1 | 46.5 Ų | 46.5 | 1% | 0.005 | 22% | 0.223 | C | C | . | . | I | π-helix | trans | -68.1 | -44.2 | -176.2 | -66.9 | 175.8 | 0 | 0 | 0 | 111.4 | F96 L129 Q130 K136 G137 M138 L172 L189 A190 H193 | F96-L134 HydrophobicContact CZ-CD2 4.32Å; L129-L134 HydrophobicContact CD1-CG 4.47Å; L129-L134 HydrophobicContact CG-CD1 4.32Å; L129-L134 HydrophobicContact CG-CG 4.48Å; L129-L134 WeakPolarHBondContact O-CG 3.37Å; L129-L134 PolarHBondContact O-N 3.5Å; Q130-L134 PolarHBondContact O-N 3.37Å; L134-K136 PolarHBondContact O-N 2.91Å; L134-G137 PolarHBondContact O-N 3.22Å; L134-M138 HydrophobicContact CD2-CE 4.37Å; L134-M138 WeakPolarHBondContact O-CB 3.43Å; L134-M138 VanDerWaalsContact O-CG 3.23Å; L134-M138 WeakPolarHBondContact O-CG 3.46Å; L134-M138 PolarHBondContact O-N 3.41Å; L134-L172 HydrophobicContact CD2-CD1 4.05Å; L134-L189 HydrophobicContact CD1-CB 4.17Å; L134-L189 HydrophobicContact CD1-CD2 3.58Å; L134-L189 HydrophobicContact CD1-CG 3.58Å; L134-A190 HydrophobicContact CD1-CB 4.46Å; L134-A190 HydrophobicContact CD2-CB 3.86Å; L134-H193 HydrophobicContact CB-CB 4.1Å; L134-H193 HydrophobicContact CD1-CB 4.48Å |
| 135 | T | 91.9 | Very high | 89.4 | Confident | 58 Ų | 58 | 41.2 Ų | 41.2 | 36% | 0.356 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -55.4 | -49 | 175.5 | -54.3 | 0 | 0 | 0 | 0 | 112.1 | Q130 V139 | Q130-T135 PolarHBondContact O-N 3.33Å; Q130-T135 PolarHBondContact O-OG1 3.04Å; T135-V139 WeakPolarHBondContact O-CB 3.49Å; T135-V139 VanDerWaalsContact O-CG2 3.25Å; T135-V139 WeakPolarHBondContact O-CG2 3.43Å; T135-V139 PolarHBondContact O-N 3.5Å; T135-V139 VanDerWaalsContact O-N 3.08Å |
| 136 | K | 91.1 | Very high | 89.7 | Confident | 97 Ų | 97 | 46.2 Ų | 46.2 | 42% | 0.422 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -68.3 | -43.2 | 179 | -68 | -179.8 | -163.9 | 172.2 | 0 | 112.3 | H89 I93 Q132 L133 L134 V139 I140 | H89-K136 PolarHBondContact NE2-NZ 3.18Å; I93-K136 HydrophobicContact CD1-CB 3.73Å; Q132-K136 WeakPolarHBondContact O-CB 3.38Å; Q132-K136 WeakPolarHBondContact O-CD 3.38Å; Q132-K136 WeakPolarHBondContact O-CG 3.4Å; L133-K136 PolarHBondContact O-N 2.93Å; L134-K136 PolarHBondContact O-N 2.91Å; K136-V139 PolarHBondContact O-N 3.05Å; K136-I140 WeakPolarHBondContact O-CG1 3.48Å; K136-I140 PolarHBondContact O-N 3.39Å |
| 137 | G | 92.6 | Very high | 90 | Very high | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.2 | -46.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | F96 L133 L134 I140 L141 | F96-G137 VanDerWaalsContact CD1-C 3.4Å; F96-G137 VanDerWaalsContact CD1-CA 3.44Å; F96-G137 VanDerWaalsContact CD1-O 3.26Å; F96-G137 WeakPolarHBondContact CD1-O 3.27Å; F96-G137 VanDerWaalsContact CE1-C 3.45Å; F96-G137 VanDerWaalsContact CG-CA 3.44Å; L133-G137 PolarHBondContact O-N 2.98Å; L134-G137 PolarHBondContact O-N 3.22Å; G137-I140 WeakPolarHBondContact O-CB 3.36Å; G137-I140 PolarHBondContact O-N 3.19Å; G137-L141 PolarHBondContact O-N 2.89Å; G137-L141 VanDerWaalsContact O-N 3.15Å |
| 138 | M | 93.1 | Very high | 90.1 | Very high | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -67.7 | -35.7 | 177 | -64.4 | -55.7 | 173.4 | 0 | 0 | 112.7 | F96 L134 I140 L141 R142 F164 A190 H193 F194 T197 I198 | F96-M138 HydrophobicContact CE1-CE 4.46Å; F96-M138 HydrophobicContact CE1-SD 4.27Å; F96-M138 HydrophobicContact CZ-CE 4.46Å; L134-M138 HydrophobicContact CD2-CE 4.37Å; L134-M138 WeakPolarHBondContact O-CB 3.43Å; L134-M138 VanDerWaalsContact O-CG 3.23Å; L134-M138 WeakPolarHBondContact O-CG 3.46Å; L134-M138 PolarHBondContact O-N 3.41Å; M138-I140 VanDerWaalsContact C-N 3.3Å; M138-I140 PolarHBondContact O-N 2.84Å; M138-L141 PolarHBondContact O-N 3.2Å; M138-L141 HydrophobicContact SD-CD1 4.25Å; M138-R142 VanDerWaalsContact O-CB 3.31Å; M138-R142 WeakPolarHBondContact O-CB 3.33Å; M138-R142 PolarHBondContact O-N 3.27Å; M138-F164 HydrophobicContact CE-CD2 4.25Å; M138-F164 HydrophobicContact CE-CE2 3.39Å; M138-F164 HydrophobicContact CE-CZ 3.61Å; M138-F164 HydrophobicContact SD-CE2 4.22Å; M138-A190 WeakPolarHBondContact CE-O 3.38Å; M138-H193 HydrophobicContact CE-CB 3.98Å; M138-H193 HydrophobicContact CG-CB 3.91Å; M138-F194 HydrophobicContact CE-CB 3.89Å; M138-F194 HydrophobicContact SD-CB 4.01Å; M138-F194 HydrophobicContact SD-CD2 4.09Å; M138-F194 HydrophobicContact SD-CG 4.47Å; M138-T197 HydrophobicContact CB-CG2 3.64Å; M138-I198 HydrophobicContact SD-CD1 4.06Å |
| 139 | V | 91.8 | Very high | 90.3 | Very high | 46 Ų | 46 | 55.4 Ų | 55.4 | 28% | 0.279 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.4 | -40.8 | 171.6 | 164.5 | 0 | 0 | 0 | 0 | 111 | T135 K136 L141 R142 D143 T197 | T135-V139 WeakPolarHBondContact O-CB 3.49Å; T135-V139 VanDerWaalsContact O-CG2 3.25Å; T135-V139 WeakPolarHBondContact O-CG2 3.43Å; T135-V139 PolarHBondContact O-N 3.5Å; T135-V139 VanDerWaalsContact O-N 3.08Å; K136-V139 PolarHBondContact O-N 3.05Å; V139-L141 VanDerWaalsContact C-N 3.34Å; V139-L141 PolarHBondContact O-N 3.03Å; V139-R142 PolarHBondContact O-N 3.4Å; V139-D143 WeakPolarHBondContact O-CB 3.47Å; V139-D143 PolarHBondContact O-N 3.44Å; V139-T197 HydrophobicContact CG2-CG2 4.48Å |
| 140 | I | 92.2 | Very high | 90.4 | Very high | 43 Ų | 43 | 55.5 Ų | 55.5 | 22% | 0.221 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.5 | -40.6 | 174.9 | -67.6 | 163.2 | 0 | 0 | 0 | 111.7 | I93 Q97 K136 G137 M138 K144 | I93-I140 HydrophobicContact CD1-CD1 4.28Å; I93-I140 HydrophobicContact CG2-CD1 3.96Å; Q97-I140 HydrophobicContact CG-CD1 4.45Å; K136-I140 WeakPolarHBondContact O-CG1 3.48Å; K136-I140 PolarHBondContact O-N 3.39Å; G137-I140 WeakPolarHBondContact O-CB 3.36Å; G137-I140 PolarHBondContact O-N 3.19Å; M138-I140 VanDerWaalsContact C-N 3.3Å; M138-I140 PolarHBondContact O-N 2.84Å; I140-K144 WeakPolarHBondContact O-CG 3.25Å; I140-K144 PolarHBondContact O-N 3.15Å |
| 141 | L | 92.4 | Very high | 90.5 | Very high | 1 Ų | 1 | 55.7 Ų | 55.7 | 1% | 0.005 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -71.3 | -46.6 | 177.8 | -63.5 | -177.6 | 0 | 0 | 0 | 112.3 | F96 G137 M138 V139 D143 K144 T160 F163 F164 I198 | F96-L141 HydrophobicContact CD1-CD1 3.84Å; F96-L141 HydrophobicContact CD1-CD2 4.35Å; F96-L141 HydrophobicContact CD1-CG 3.88Å; F96-L141 HydrophobicContact CE1-CD1 3.81Å; F96-L141 HydrophobicContact CE1-CG 4.29Å; G137-L141 PolarHBondContact O-N 2.89Å; G137-L141 VanDerWaalsContact O-N 3.15Å; M138-L141 PolarHBondContact O-N 3.2Å; M138-L141 HydrophobicContact SD-CD1 4.25Å; V139-L141 VanDerWaalsContact C-N 3.34Å; V139-L141 PolarHBondContact O-N 3.03Å; L141-D143 VanDerWaalsContact C-N 3.3Å; L141-D143 PolarHBondContact O-N 3.22Å; L141-K144 WeakPolarHBondContact O-CB 3.39Å; L141-K144 PolarHBondContact O-N 3.05Å; L141-T160 HydrophobicContact CB-CG2 4.05Å; L141-T160 HydrophobicContact CD2-CG2 4.34Å; L141-F163 HydrophobicContact CD2-CD1 4Å; L141-F163 HydrophobicContact CD2-CE1 3.87Å; L141-F164 HydrophobicContact CD1-CB 4.05Å; L141-F164 HydrophobicContact CD1-CD2 3.84Å; L141-F164 HydrophobicContact CD1-CG 4.22Å; L141-I198 HydrophobicContact CB-CD1 3.75Å; L141-I198 HydrophobicContact CD1-CD1 4.33Å |
| 142 | R | 91.8 | Very high | 90.7 | Very high | 67 Ų | 67 | 58.6 Ų | 58.6 | 25% | 0.253 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -57.1 | -45.4 | 175.3 | -174.8 | -159.6 | 64 | -169.9 | -3.3 | 110.9 | M138 V139 K144 I145 R146 T197 I198 S201 V202 | M138-R142 VanDerWaalsContact O-CB 3.31Å; M138-R142 WeakPolarHBondContact O-CB 3.33Å; M138-R142 PolarHBondContact O-N 3.27Å; V139-R142 PolarHBondContact O-N 3.4Å; R142-K144 PolarHBondContact O-N 3.46Å; R142-I145 PolarHBondContact O-N 3.48Å; R142-R146 WeakPolarHBondContact O-CB 3.36Å; R142-R146 PolarHBondContact O-N 2.58Å; R142-T197 WeakPolarHBondContact CD-O 3.26Å; R142-I198 HydrophobicContact CB-CG1 4.05Å; R142-S201 WeakPolarHBondContact CD-OG 3.28Å; R142-V202 HydrophobicContact CG-CG2 4.14Å |
| 143 | D | 92.4 | Very high | 90.8 | Very high | 46 Ų | 46 | 55.7 Ų | 55.7 | 25% | 0.246 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.5 | -23.1 | -175.8 | -73.4 | 13.4 | 0 | 0 | 0 | 112.9 | V139 L141 R146 | V139-D143 WeakPolarHBondContact O-CB 3.47Å; V139-D143 PolarHBondContact O-N 3.44Å; L141-D143 VanDerWaalsContact C-N 3.3Å; L141-D143 PolarHBondContact O-N 3.22Å; D143-R146 VanDerWaalsContact CG-CZ 3.46Å; D143-R146 IonicContact OD1-CZ 3.39Å; D143-R146 IonicContact OD1-NE 3.62Å; D143-R146 IonicContact OD1-NH1 2.72Å; D143-R146 PolarHBondContact OD1-NH1 3.36Å; D143-R146 IonicContact OD2-CZ 3.97Å; D143-R146 IonicContact OD2-NH1 3.58Å; D143-R146 PolarHBondContact OD2-NH1 2.72Å; D143-R146 IonicContact OD2-NH2 2.71Å |
| 144 | K | 88.6 | Confident | 90.9 | Very high | 84 Ų | 84 | 55.7 Ų | 55.7 | 37% | 0.365 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -68 | -33.2 | 168.6 | -72.5 | 166.1 | 177.6 | 174.1 | 0 | 112.8 | F96 I140 L141 R142 Y148 | F96-K144 PolarHBondContact O-NZ 3.14Å; F96-K144 VanDerWaalsContact O-NZ 3.15Å; I140-K144 WeakPolarHBondContact O-CG 3.25Å; I140-K144 PolarHBondContact O-N 3.15Å; L141-K144 WeakPolarHBondContact O-CB 3.39Å; L141-K144 PolarHBondContact O-N 3.05Å; R142-K144 PolarHBondContact O-N 3.46Å; K144-Y148 VanDerWaalsContact O-CE2 3.32Å; K144-Y148 WeakPolarHBondContact O-CE2 3.48Å |
| 145 | I | 91.6 | Very high | 91 | Very high | 3 Ų | 3 | 58.9 Ų | 58.9 | 2% | 0.015 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -110.8 | -15.7 | -172.6 | 69.9 | 171.8 | 0 | 0 | 0 | 116 | R142 Y147 Y148 L153 L157 T160 I198 V202 | R142-I145 PolarHBondContact O-N 3.48Å; I145-Y147 PolarHBondContact O-N 2.82Å; I145-Y148 HydrophobicContact CB-CD2 4.2Å; I145-Y148 HydrophobicContact CG2-CD2 4.43Å; I145-Y148 PolarHBondContact O-N 3.08Å; I145-L153 HydrophobicContact CB-CD1 4.49Å; I145-L153 HydrophobicContact CD1-CD1 4.43Å; I145-L157 HydrophobicContact CD1-CB 4.35Å; I145-L157 HydrophobicContact CD1-CD1 3.7Å; I145-T160 HydrophobicContact CG2-CG2 4.46Å; I145-T160 VanDerWaalsContact CG2-OG1 3.23Å; I145-T160 WeakPolarHBondContact CG2-OG1 3.47Å; I145-I198 HydrophobicContact CD1-CG2 3.82Å; I145-V202 HydrophobicContact CD1-CG2 4.48Å; I145-V202 HydrophobicContact CG1-CG2 4.41Å |
| 146 | R | 89.1 | Confident | 91.1 | Very high | 107 Ų | 107 | 57.1 Ų | 57.1 | 40% | 0.404 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -14 | -175.4 | 70.7 | 177.5 | -178.9 | -151.8 | -6.1 | 115.6 | R142 D143 | R142-R146 WeakPolarHBondContact O-CB 3.36Å; R142-R146 PolarHBondContact O-N 2.58Å; D143-R146 VanDerWaalsContact CG-CZ 3.46Å; D143-R146 IonicContact OD1-CZ 3.39Å; D143-R146 IonicContact OD1-NE 3.62Å; D143-R146 IonicContact OD1-NH1 2.72Å; D143-R146 PolarHBondContact OD1-NH1 3.36Å; D143-R146 IonicContact OD2-CZ 3.97Å; D143-R146 IonicContact OD2-NH1 3.58Å; D143-R146 PolarHBondContact OD2-NH1 2.72Å; D143-R146 IonicContact OD2-NH2 2.71Å |
| 147 | Y | 88.6 | Confident | 91.2 | Very high | 173 Ų | 173 | 52.8 Ų | 52.8 | 68% | 0.678 | 24% | 0.238 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -99 | -4.4 | -179.6 | -61.8 | -71.1 | 0 | 0 | 0 | 113.6 | I145 | I145-Y147 PolarHBondContact O-N 2.82Š|
| 148 | Y | 89.8 | Confident | 91.3 | Very high | 105 Ų | 105 | 53.1 Ų | 53.1 | 41% | 0.412 | 24% | 0.241 | S | C | . | . | trans | -91.6 | 147.2 | 173.5 | -57.3 | -57.6 | 0 | 0 | 0 | 110.5 | K144 I145 S156 | K144-Y148 VanDerWaalsContact O-CE2 3.32Å; K144-Y148 WeakPolarHBondContact O-CE2 3.48Å; I145-Y148 HydrophobicContact CB-CD2 4.2Å; I145-Y148 HydrophobicContact CG2-CD2 4.43Å; I145-Y148 PolarHBondContact O-N 3.08Å; Y148-S156 WeakPolarHBondContact CD2-OG 3.36Å; Y148-S156 WeakPolarHBondContact CE2-OG 3.44Å | ||
| 149 | E | 89 | Confident | 91.4 | Very high | 121 Ų | 121 | 59.3 Ų | 59.3 | 57% | 0.565 | 27% | 0.27 | S | S | * | . | trans | -136.8 | 155.6 | 176.7 | -63.2 | -169.3 | 149.6 | 0 | 0 | 110.8 | K203 | E149-K203 IonicContact OE1-NZ 3.08Å; E149-K203 PolarHBondContact OE1-NZ 2.81Å | ||
| 150 | G | 87.9 | Confident | 91.5 | Very high | 7 Ų | 7 | 57.9 Ų | 57.9 | 7% | 0.072 | 26% | 0.261 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 63.5 | -140.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | K152 L153 L154 | G150-K152 VanDerWaalsContact C-N 3.32Å; G150-K152 PolarHBondContact O-N 3.14Å; G150-L153 WeakPolarHBondContact O-CB 3.19Å; G150-L153 PolarHBondContact O-N 3.28Å; G150-L154 PolarHBondContact O-N 3.1Å |
| 151 | Q | 90.4 | Very high | 91.7 | Very high | 59 Ų | 59 | 55.8 Ų | 55.8 | 28% | 0.276 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -57.9 | -41.7 | -175.8 | -173.1 | 60.6 | 42.7 | 0 | 0 | 113 | L153 L154 D155 R214 | Q151-L153 PolarHBondContact O-N 3.34Å; Q151-L154 WeakPolarHBondContact O-CB 3.48Å; Q151-L154 PolarHBondContact O-N 3.1Å; Q151-D155 PolarHBondContact NE2-OD1 2.86Å; Q151-D155 VanDerWaalsContact O-CG 3.26Å; Q151-D155 PolarHBondContact O-N 3.19Å; Q151-R214 PolarHBondContact NE2-O 3.46Å; Q151-R214 PolarHBondContact OE1-O 3.31Å |
| 152 | K | 90.6 | Very high | 91.8 | Very high | 151 Ų | 151 | 58.6 Ų | 58.6 | 66% | 0.657 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -60.9 | -31.4 | 178.1 | -70.2 | -172.9 | 177.2 | -176.3 | 0 | 112.5 | G150 S156 | G150-K152 VanDerWaalsContact C-N 3.32Å; G150-K152 PolarHBondContact O-N 3.14Å; K152-S156 VanDerWaalsContact O-CB 3.3Å; K152-S156 WeakPolarHBondContact O-CB 3.32Å; K152-S156 PolarHBondContact O-N 2.92Å; K152-S156 PolarHBondContact O-OG 3.22Å; K152-S156 VanDerWaalsContact O-OG 3.11Å |
| 153 | L | 91.7 | Very high | 91.9 | Very high | 1 Ų | 1 | 56.2 Ų | 56.2 | 1% | 0.005 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -66.5 | -44.5 | 173 | 172.6 | 58.9 | 0 | 0 | 0 | 111 | I145 G150 Q151 L157 V202 A207 | I145-L153 HydrophobicContact CB-CD1 4.49Å; I145-L153 HydrophobicContact CD1-CD1 4.43Å; G150-L153 WeakPolarHBondContact O-CB 3.19Å; G150-L153 PolarHBondContact O-N 3.28Å; Q151-L153 PolarHBondContact O-N 3.34Å; L153-L157 WeakPolarHBondContact O-CB 3.45Å; L153-L157 PolarHBondContact O-N 3.35Å; L153-V202 HydrophobicContact CD1-CG1 3.57Å; L153-V202 HydrophobicContact CD2-CG1 3.74Å; L153-V202 HydrophobicContact CG-CG1 4.29Å; L153-A207 HydrophobicContact CD2-CB 4.01Å |
| 154 | L | 92.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.6 | -43.5 | 178 | -58.2 | 179.5 | 0 | 0 | 0 | 111.5 | G150 Q151 L157 A158 L204 A207 L208 A213 P216 | G150-L154 PolarHBondContact O-N 3.1Å; Q151-L154 WeakPolarHBondContact O-CB 3.48Å; Q151-L154 PolarHBondContact O-N 3.1Å; L154-L157 PolarHBondContact O-N 3.17Å; L154-A158 PolarHBondContact O-N 3Å; L154-L204 HydrophobicContact CD2-CD1 3.45Å; L154-L204 VanDerWaalsContact CD2-CD1 3.45Å; L154-A207 HydrophobicContact CD2-CB 3.98Å; L154-A207 HydrophobicContact CG-CB 4.22Å; L154-L208 HydrophobicContact CD1-CD2 4.34Å; L154-L208 HydrophobicContact CD2-CD2 3.83Å; L154-L208 HydrophobicContact CD2-CG 4.34Å; L154-A213 HydrophobicContact CD1-CB 4.04Å; L154-P216 HydrophobicContact CB-CG 4.3Å |
| 155 | D | 93.4 | Very high | 92.3 | Very high | 67 Ų | 67 | 51.8 Ų | 51.8 | 36% | 0.358 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -65.3 | -48.9 | 178.6 | -55.5 | -28 | 0 | 0 | 0 | 111.1 | Q151 L157 A158 E159 | Q151-D155 PolarHBondContact NE2-OD1 2.86Å; Q151-D155 VanDerWaalsContact O-CG 3.26Å; Q151-D155 PolarHBondContact O-N 3.19Å; D155-L157 VanDerWaalsContact C-N 3.31Å; D155-L157 PolarHBondContact O-N 2.6Å; D155-A158 WeakPolarHBondContact O-CB 3.42Å; D155-A158 PolarHBondContact O-N 3.33Å; D155-E159 PolarHBondContact O-N 3.43Å; D155-E159 VanDerWaalsContact O-N 3.1Å |
| 156 | S | 93.4 | Very high | 92.4 | Very high | 22 Ų | 22 | 55.1 Ų | 55.1 | 15% | 0.154 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.6 | -28.1 | 176.5 | -64.6 | 0 | 0 | 0 | 0 | 113.6 | Y148 K152 T160 | Y148-S156 WeakPolarHBondContact CD2-OG 3.36Å; Y148-S156 WeakPolarHBondContact CE2-OG 3.44Å; K152-S156 VanDerWaalsContact O-CB 3.3Å; K152-S156 WeakPolarHBondContact O-CB 3.32Å; K152-S156 PolarHBondContact O-N 2.92Å; K152-S156 PolarHBondContact O-OG 3.22Å; K152-S156 VanDerWaalsContact O-OG 3.11Å; S156-T160 VanDerWaalsContact O-CB 3.24Å; S156-T160 WeakPolarHBondContact O-CB 3.16Å; S156-T160 PolarHBondContact O-N 3.18Å; S156-T160 PolarHBondContact O-OG1 2.85Å |
| 157 | L | 93.5 | Very high | 92.6 | Very high | 5 Ų | 5 | 54.2 Ų | 54.2 | 3% | 0.026 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -71.1 | -38.8 | 173 | 178.4 | 60.3 | 0 | 0 | 0 | 111.1 | I145 L153 L154 D155 T160 W161 F194 I198 L204 V219 M222 | I145-L157 HydrophobicContact CD1-CB 4.35Å; I145-L157 HydrophobicContact CD1-CD1 3.7Å; L153-L157 WeakPolarHBondContact O-CB 3.45Å; L153-L157 PolarHBondContact O-N 3.35Å; L154-L157 PolarHBondContact O-N 3.17Å; D155-L157 VanDerWaalsContact C-N 3.31Å; D155-L157 PolarHBondContact O-N 2.6Å; L157-T160 PolarHBondContact O-N 3.17Å; L157-W161 VanDerWaalsContact O-CB 3.29Å; L157-W161 WeakPolarHBondContact O-CB 3.34Å; L157-W161 PolarHBondContact O-N 2.92Å; L157-F194 HydrophobicContact CD1-CZ 4.36Å; L157-I198 HydrophobicContact CD1-CG2 3.95Å; L157-L204 HydrophobicContact CD2-CD1 3.58Å; L157-L204 HydrophobicContact CD2-CD2 3.97Å; L157-L204 HydrophobicContact CD2-CG 4.34Å; L157-V219 HydrophobicContact CD2-CG1 4.48Å; L157-V219 HydrophobicContact CG-CG2 4.37Å; L157-M222 HydrophobicContact CD1-SD 4.1Å; L157-M222 HydrophobicContact CD2-CE 4.02Å; L157-M222 HydrophobicContact CG-CE 4.32Å; L157-M222 HydrophobicContact CG-SD 4.25Å |
| 158 | A | 94.3 | Very high | 92.9 | Very high | 8 Ų | 8 | 46 Ų | 46 | 7% | 0.066 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -58.4 | -53.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | L154 D155 T160 W161 D162 P216 V219 | L154-A158 PolarHBondContact O-N 3Å; D155-A158 WeakPolarHBondContact O-CB 3.42Å; D155-A158 PolarHBondContact O-N 3.33Å; A158-T160 VanDerWaalsContact C-N 3.26Å; A158-T160 PolarHBondContact O-N 3.25Å; A158-W161 PolarHBondContact O-N 3.03Å; A158-D162 PolarHBondContact O-N 2.97Å; A158-P216 HydrophobicContact CB-CB 3.79Å; A158-P216 HydrophobicContact CB-CG 4.04Å; A158-V219 HydrophobicContact CB-CG2 4Å |
| 159 | E | 94.8 | Very high | 93 | Very high | 130 Ų | 130 | 41 Ų | 41 | 61% | 0.607 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -59.7 | -35.7 | 177.3 | -69.2 | -178.4 | -163.5 | 0 | 0 | 113.2 | D155 F163 | D155-E159 PolarHBondContact O-N 3.43Å; D155-E159 VanDerWaalsContact O-N 3.1Å; E159-F163 VanDerWaalsContact O-CB 3.26Å; E159-F163 WeakPolarHBondContact O-CB 3.24Å; E159-F163 PolarHBondContact O-N 3.11Å; E159-F163 VanDerWaalsContact O-N 3.14Å |
| 160 | T | 94.6 | Very high | 93.2 | Very high | 15 Ų | 15 | 38.2 Ų | 38.2 | 9% | 0.092 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -74.6 | -37 | 178.9 | -61.9 | 0 | 0 | 0 | 0 | 111.7 | L141 I145 S156 L157 A158 F164 | L141-T160 HydrophobicContact CB-CG2 4.05Å; L141-T160 HydrophobicContact CD2-CG2 4.34Å; I145-T160 HydrophobicContact CG2-CG2 4.46Å; I145-T160 VanDerWaalsContact CG2-OG1 3.23Å; I145-T160 WeakPolarHBondContact CG2-OG1 3.47Å; S156-T160 VanDerWaalsContact O-CB 3.24Å; S156-T160 WeakPolarHBondContact O-CB 3.16Å; S156-T160 PolarHBondContact O-N 3.18Å; S156-T160 PolarHBondContact O-OG1 2.85Å; L157-T160 PolarHBondContact O-N 3.17Å; A158-T160 VanDerWaalsContact C-N 3.26Å; A158-T160 PolarHBondContact O-N 3.25Å; T160-F164 WeakPolarHBondContact O-CB 3.42Å; T160-F164 PolarHBondContact O-N 2.89Å |
| 161 | W | 94.8 | Very high | 93.5 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66.4 | -49.7 | 172.9 | 169.6 | -104.7 | 0 | 0 | 0 | 111.5 | L157 A158 F163 F164 F165 L191 F194 M222 I225 L226 | L157-W161 VanDerWaalsContact O-CB 3.29Å; L157-W161 WeakPolarHBondContact O-CB 3.34Å; L157-W161 PolarHBondContact O-N 2.92Å; A158-W161 PolarHBondContact O-N 3.03Å; W161-F163 VanDerWaalsContact C-N 3.31Å; W161-F163 PolarHBondContact O-N 2.99Å; W161-F164 AromaticContact CE3-CD1 3.92Å; W161-F164 HydrophobicContact CE3-CD1 3.92Å; W161-F164 AromaticContact CZ3-CD1 3.84Å; W161-F164 HydrophobicContact CZ3-CD1 3.84Å; W161-F164 HydrophobicContact CZ3-CE1 4.07Å; W161-F164 CarbonylContact O-C 3.56Å; W161-F164 PolarHBondContact O-N 3.47Å; W161-F165 HydrophobicContact CD2-CB 4.17Å; W161-F165 HydrophobicContact CE3-CB 4.48Å; W161-F165 HydrophobicContact CH2-CB 4.29Å; W161-F165 AromaticContact CH2-CD2 3.45Å; W161-F165 HydrophobicContact CH2-CD2 3.45Å; W161-F165 VanDerWaalsContact CH2-CD2 3.45Å; W161-F165 HydrophobicContact CH2-CE2 4.09Å; W161-F165 HydrophobicContact CH2-CG 4.18Å; W161-F165 HydrophobicContact CZ2-CB 3.88Å; W161-F165 AromaticContact CZ2-CD2 3.28Å; W161-F165 HydrophobicContact CZ2-CD2 3.28Å; W161-F165 AromaticContact CZ2-CE2 3.86Å; W161-F165 HydrophobicContact CZ2-CE2 3.86Å; W161-F165 AromaticContact CZ2-CG 3.67Å; W161-F165 HydrophobicContact CZ2-CG 3.67Å; W161-F165 HydrophobicContact CZ3-CD2 4.33Å; W161-F165 WeakPolarHBondContact O-CB 3.48Å; W161-F165 PolarHBondContact O-N 3.49Å; W161-L191 HydrophobicContact CH2-CD2 3.67Å; W161-L191 HydrophobicContact CZ3-CD2 4.04Å; W161-F194 HydrophobicContact CB-CZ 4.38Å; W161-F194 HydrophobicContact CE3-CD1 4.16Å; W161-F194 HydrophobicContact CE3-CD2 4.41Å; W161-F194 AromaticContact CE3-CE1 3.79Å; W161-F194 HydrophobicContact CE3-CE1 3.79Å; W161-F194 HydrophobicContact CE3-CE2 4.04Å; W161-F194 HydrophobicContact CE3-CG 4.48Å; W161-F194 AromaticContact CE3-CZ 3.73Å; W161-F194 HydrophobicContact CE3-CZ 3.73Å; W161-F194 HydrophobicContact CZ3-CD1 4.15Å; W161-F194 HydrophobicContact CZ3-CE1 4.23Å; W161-F194 HydrophobicContact CZ3-CG 4.37Å; W161-F194 HydrophobicContact CZ3-CZ 4.5Å; W161-M222 HydrophobicContact CB-CG 4.49Å; W161-M222 HydrophobicContact CB-SD 4.06Å; W161-M222 HydrophobicContact CD2-CB 3.53Å; W161-M222 HydrophobicContact CD2-CG 3.5Å; W161-M222 VanDerWaalsContact CD2-CG 3.5Å; W161-M222 HydrophobicContact CD2-SD 4.17Å; W161-M222 HydrophobicContact CE3-CB 4.07Å; W161-M222 HydrophobicContact CE3-CG 3.49Å; W161-M222 VanDerWaalsContact CE3-CG 3.49Å; W161-M222 HydrophobicContact CE3-SD 4.1Å; W161-M222 HydrophobicContact CG-CB 3.72Å; W161-M222 HydrophobicContact CG-CG 3.95Å; W161-M222 HydrophobicContact CG-SD 4.16Å; W161-M222 HydrophobicContact CH2-CG 4.24Å; W161-M222 HydrophobicContact CZ2-CB 4.09Å; W161-M222 HydrophobicContact CZ2-CG 4.31Å; W161-M222 HydrophobicContact CZ3-CG 3.86Å; W161-I225 HydrophobicContact CH2-CB 4.47Å; W161-I225 HydrophobicContact CH2-CG2 4.06Å; W161-I225 HydrophobicContact CZ2-CB 4.35Å; W161-I225 HydrophobicContact CZ2-CD1 4.06Å; W161-I225 HydrophobicContact CZ2-CG2 4.27Å; W161-L226 HydrophobicContact CZ3-CD2 4.4Å |
| 162 | D | 95.4 | Very high | 93.6 | Very high | 60 Ų | 60 | 37.8 Ų | 37.8 | 32% | 0.321 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -61.6 | -43.2 | -178 | -68.7 | -24.7 | 0 | 0 | 0 | 110.4 | A158 C166 S218 | A158-D162 PolarHBondContact O-N 2.97Å; D162-C166 WeakPolarHBondContact O-CB 3.33Å; D162-C166 PolarHBondContact O-N 3.46Å; D162-S218 VanDerWaalsContact OD1-CB 3.26Å; D162-S218 WeakPolarHBondContact OD1-CB 3.37Å; D162-S218 PolarHBondContact OD1-OG 3.28Å; D162-S218 WeakPolarHBondContact OD2-CB 3.47Å; D162-S218 PolarHBondContact OD2-OG 3.06Å |
| 163 | F | 94.9 | Very high | 93.6 | Very high | 17 Ų | 17 | 34.1 Ų | 34.1 | 8% | 0.075 | 19% | 0.185 | C | C | . | . | I | π-helix | trans | -59.7 | -45.6 | 170.4 | 171.5 | -120 | 0 | 0 | 0 | 113 | V95 K98 L141 E159 W161 D167 V168 | V95-F163 WeakPolarHBondContact O-CZ 3.38Å; K98-F163 HydrophobicContact CB-CE2 4.39Å; K98-F163 HydrophobicContact CB-CZ 4.2Å; K98-F163 HydrophobicContact CD-CD2 4.22Å; K98-F163 HydrophobicContact CD-CE1 4.47Å; K98-F163 HydrophobicContact CD-CE2 4.25Å; K98-F163 HydrophobicContact CD-CG 4.39Å; K98-F163 HydrophobicContact CD-CZ 4.35Å; K98-F163 HydrophobicContact CG-CD1 4.16Å; K98-F163 HydrophobicContact CG-CD2 3.85Å; K98-F163 HydrophobicContact CG-CE1 3.67Å; K98-F163 HydrophobicContact CG-CE2 3.38Å; K98-F163 HydrophobicContact CG-CG 4.24Å; K98-F163 HydrophobicContact CG-CZ 3.26Å; L141-F163 HydrophobicContact CD2-CD1 4Å; L141-F163 HydrophobicContact CD2-CE1 3.87Å; E159-F163 VanDerWaalsContact O-CB 3.26Å; E159-F163 WeakPolarHBondContact O-CB 3.24Å; E159-F163 PolarHBondContact O-N 3.11Å; E159-F163 VanDerWaalsContact O-N 3.14Å; W161-F163 VanDerWaalsContact C-N 3.31Å; W161-F163 PolarHBondContact O-N 2.99Å; F163-D167 HydrophobicContact CD2-CB 3.87Å; F163-D167 VanDerWaalsContact CD2-OD2 3.31Å; F163-D167 WeakPolarHBondContact CD2-OD2 3.35Å; F163-D167 HydrophobicContact CE2-CB 3.81Å; F163-D167 WeakPolarHBondContact O-CB 3.49Å; F163-D167 PolarHBondContact O-N 3.43Å; F163-D167 VanDerWaalsContact O-N 3.11Å; F163-V168 HydrophobicContact CD1-CG2 4.05Å; F163-V168 HydrophobicContact CD2-CG2 4.41Å; F163-V168 HydrophobicContact CE1-CG2 3.46Å; F163-V168 VanDerWaalsContact CE1-CG2 3.46Å; F163-V168 HydrophobicContact CE2-CG2 3.82Å; F163-V168 HydrophobicContact CG-CG2 4.49Å; F163-V168 HydrophobicContact CZ-CG2 3.31Å; F163-V168 PolarHBondContact O-N 2.93Å; F163-V168 VanDerWaalsContact O-N 3.13Å |
| 164 | F | 95 | Very high | 93.6 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 20% | 0.198 | C | C | . | . | I | π-helix | trans | -65.7 | -45.2 | -179.6 | 169.7 | -104 | 0 | 0 | 0 | 112.2 | F96 M138 L141 T160 W161 V168 L169 A190 L191 F194 | F96-F164 HydrophobicContact CE1-CD2 4.36Å; F96-F164 HydrophobicContact CE1-CE2 4.43Å; M138-F164 HydrophobicContact CE-CD2 4.25Å; M138-F164 HydrophobicContact CE-CE2 3.39Å; M138-F164 HydrophobicContact CE-CZ 3.61Å; M138-F164 HydrophobicContact SD-CE2 4.22Å; L141-F164 HydrophobicContact CD1-CB 4.05Å; L141-F164 HydrophobicContact CD1-CD2 3.84Å; L141-F164 HydrophobicContact CD1-CG 4.22Å; T160-F164 WeakPolarHBondContact O-CB 3.42Å; T160-F164 PolarHBondContact O-N 2.89Å; W161-F164 AromaticContact CE3-CD1 3.92Å; W161-F164 HydrophobicContact CE3-CD1 3.92Å; W161-F164 AromaticContact CZ3-CD1 3.84Å; W161-F164 HydrophobicContact CZ3-CD1 3.84Å; W161-F164 HydrophobicContact CZ3-CE1 4.07Å; W161-F164 CarbonylContact O-C 3.56Å; W161-F164 PolarHBondContact O-N 3.47Å; F164-V168 HydrophobicContact CD2-CB 3.99Å; F164-V168 HydrophobicContact CD2-CG1 4.06Å; F164-V168 HydrophobicContact CE2-CG1 4.31Å; F164-V168 WeakPolarHBondContact O-CB 3.06Å; F164-V168 PolarHBondContact O-N 3.09Å; F164-L169 WeakPolarHBondContact O-CB 3.43Å; F164-L169 PolarHBondContact O-N 2.96Å; F164-A190 HydrophobicContact CZ-CB 4.01Å; F164-L191 HydrophobicContact CE1-CD2 4.2Å; F164-F194 HydrophobicContact CB-CD2 4.14Å; F164-F194 HydrophobicContact CB-CE2 3.88Å; F164-F194 HydrophobicContact CD1-CB 4.42Å; F164-F194 AromaticContact CD1-CD2 3.28Å; F164-F194 HydrophobicContact CD1-CD2 3.28Å; F164-F194 AromaticContact CD1-CE2 3.72Å; F164-F194 HydrophobicContact CD1-CE2 3.72Å; F164-F194 AromaticContact CD1-CG 3.99Å; F164-F194 HydrophobicContact CD1-CG 3.99Å; F164-F194 HydrophobicContact CD2-CD2 4.09Å; F164-F194 HydrophobicContact CE1-CB 3.89Å; F164-F194 AromaticContact CE1-CD2 3.64Å; F164-F194 HydrophobicContact CE1-CD2 3.64Å; F164-F194 HydrophobicContact CE1-CE2 4.49Å; F164-F194 AromaticContact CE1-CG 3.95Å; F164-F194 HydrophobicContact CE1-CG 3.95Å; F164-F194 HydrophobicContact CE2-CD2 4.4Å; F164-F194 AromaticContact CG-CD2 3.53Å; F164-F194 HydrophobicContact CG-CD2 3.53Å; F164-F194 AromaticContact CG-CE2 3.8Å; F164-F194 HydrophobicContact CG-CE2 3.8Å; F164-F194 HydrophobicContact CZ-CB 4.15Å; F164-F194 HydrophobicContact CZ-CD2 4.19Å |
| 165 | F | 93.8 | Very high | 93.5 | Very high | 37 Ų | 37 | 35.6 Ų | 35.6 | 16% | 0.162 | 20% | 0.198 | C | C | . | . | I | π-helix | trans | -79.2 | -39 | -171.9 | -172.5 | -96.6 | 0 | 0 | 0 | 112.7 | W161 L169 L191 I225 | W161-F165 HydrophobicContact CD2-CB 4.17Å; W161-F165 HydrophobicContact CE3-CB 4.48Å; W161-F165 HydrophobicContact CH2-CB 4.29Å; W161-F165 AromaticContact CH2-CD2 3.45Å; W161-F165 HydrophobicContact CH2-CD2 3.45Å; W161-F165 VanDerWaalsContact CH2-CD2 3.45Å; W161-F165 HydrophobicContact CH2-CE2 4.09Å; W161-F165 HydrophobicContact CH2-CG 4.18Å; W161-F165 HydrophobicContact CZ2-CB 3.88Å; W161-F165 AromaticContact CZ2-CD2 3.28Å; W161-F165 HydrophobicContact CZ2-CD2 3.28Å; W161-F165 AromaticContact CZ2-CE2 3.86Å; W161-F165 HydrophobicContact CZ2-CE2 3.86Å; W161-F165 AromaticContact CZ2-CG 3.67Å; W161-F165 HydrophobicContact CZ2-CG 3.67Å; W161-F165 HydrophobicContact CZ3-CD2 4.33Å; W161-F165 WeakPolarHBondContact O-CB 3.48Å; W161-F165 PolarHBondContact O-N 3.49Å; F165-L169 HydrophobicContact CD2-CD2 3.74Å; F165-L169 HydrophobicContact CE2-CD2 4.07Å; F165-L169 HydrophobicContact CG-CD2 4.45Å; F165-L191 HydrophobicContact CD2-CD2 4.32Å; F165-L191 HydrophobicContact CE2-CD2 4.47Å; F165-I225 HydrophobicContact CE1-CD1 4.44Å; F165-I225 HydrophobicContact CE2-CD1 3.85Å; F165-I225 HydrophobicContact CE2-CG2 4.09Å; F165-I225 HydrophobicContact CZ-CD1 3.71Å |
| 166 | C | 93.5 | Very high | 93.4 | Very high | 72 Ų | 72 | 32.6 Ų | 32.6 | 49% | 0.486 | 18% | 0.181 | S | C | . | . | I | π-helix | trans | -83.1 | -48.8 | 179.9 | -64.1 | 0 | 0 | 0 | 0 | 111.9 | D162 S170 | D162-C166 WeakPolarHBondContact O-CB 3.33Å; D162-C166 PolarHBondContact O-N 3.46Å; C166-S170 WeakPolarHBondContact O-CB 3.36Å; C166-S170 PolarHBondContact O-OG 3.39Å |
| 167 | D | 93.2 | Very high | 93.2 | Very high | 89 Ų | 89 | 36.5 Ų | 36.5 | 48% | 0.476 | 20% | 0.197 | S | C | . | . | I | π-helix | trans | -94.3 | -61.4 | -173.1 | -56.9 | -45.8 | 0 | 0 | 0 | 111.9 | F163 L169 S170 M171 | F163-D167 HydrophobicContact CD2-CB 3.87Å; F163-D167 VanDerWaalsContact CD2-OD2 3.31Å; F163-D167 WeakPolarHBondContact CD2-OD2 3.35Å; F163-D167 HydrophobicContact CE2-CB 3.81Å; F163-D167 WeakPolarHBondContact O-CB 3.49Å; F163-D167 PolarHBondContact O-N 3.43Å; F163-D167 VanDerWaalsContact O-N 3.11Å; D167-L169 PolarHBondContact O-N 3.01Å; D167-S170 PolarHBondContact O-N 3.37Å; D167-M171 WeakPolarHBondContact O-CB 3.37Å; D167-M171 VanDerWaalsContact O-CG 3.27Å; D167-M171 WeakPolarHBondContact O-CG 3.43Å; D167-M171 PolarHBondContact O-N 3.35Å |
| 168 | V | 94.2 | Very high | 92.8 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 21% | 0.206 | C | C | . | . | I | π-helix | trans | -64 | -47 | -170.7 | -178.6 | 0 | 0 | 0 | 0 | 111.6 | V95 F96 F163 F164 M171 L172 | V95-V168 HydrophobicContact CG1-CB 4.28Å; V95-V168 HydrophobicContact CG1-CG1 4.15Å; V95-V168 HydrophobicContact CG1-CG2 4.22Å; F96-V168 HydrophobicContact CD1-CG1 3.84Å; F96-V168 HydrophobicContact CD2-CG1 4.07Å; F96-V168 HydrophobicContact CE1-CG1 3.63Å; F96-V168 HydrophobicContact CE2-CG1 3.84Å; F96-V168 HydrophobicContact CG-CG1 4.07Å; F96-V168 HydrophobicContact CZ-CG1 3.62Å; F163-V168 HydrophobicContact CD1-CG2 4.05Å; F163-V168 HydrophobicContact CD2-CG2 4.41Å; F163-V168 HydrophobicContact CE1-CG2 3.46Å; F163-V168 VanDerWaalsContact CE1-CG2 3.46Å; F163-V168 HydrophobicContact CE2-CG2 3.82Å; F163-V168 HydrophobicContact CG-CG2 4.49Å; F163-V168 HydrophobicContact CZ-CG2 3.31Å; F163-V168 PolarHBondContact O-N 2.93Å; F163-V168 VanDerWaalsContact O-N 3.13Å; F164-V168 HydrophobicContact CD2-CB 3.99Å; F164-V168 HydrophobicContact CD2-CG1 4.06Å; F164-V168 HydrophobicContact CE2-CG1 4.31Å; F164-V168 WeakPolarHBondContact O-CB 3.06Å; F164-V168 PolarHBondContact O-N 3.09Å; V168-M171 PolarHBondContact O-N 2.94Å; V168-L172 HydrophobicContact CG1-CD1 3.92Å; V168-L172 HydrophobicContact CG1-CG 4.33Å; V168-L172 WeakPolarHBondContact O-CB 3.45Å; V168-L172 VanDerWaalsContact O-CG 3.24Å; V168-L172 WeakPolarHBondContact O-CG 3.26Å; V168-L172 PolarHBondContact O-N 2.83Å |
| 169 | L | 93.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.1 | -44 | -178.2 | -178.7 | 57.9 | 0 | 0 | 0 | 111.5 | F164 F165 D167 L172 Q173 R187 A190 L191 | F164-L169 WeakPolarHBondContact O-CB 3.43Å; F164-L169 PolarHBondContact O-N 2.96Å; F165-L169 HydrophobicContact CD2-CD2 3.74Å; F165-L169 HydrophobicContact CE2-CD2 4.07Å; F165-L169 HydrophobicContact CG-CD2 4.45Å; D167-L169 PolarHBondContact O-N 3.01Å; L169-L172 PolarHBondContact O-N 2.96Å; L169-Q173 WeakPolarHBondContact O-CB 3.38Å; L169-Q173 VanDerWaalsContact O-CG 3.3Å; L169-Q173 WeakPolarHBondContact O-CG 3.31Å; L169-Q173 PolarHBondContact O-N 3.15Å; L169-R187 HydrophobicContact CD1-CB 4.44Å; L169-R187 HydrophobicContact CD1-CG 4.27Å; L169-R187 HydrophobicContact CD2-CG 4.45Å; L169-A190 HydrophobicContact CD1-CB 3.88Å; L169-L191 HydrophobicContact CD2-CD2 4.22Å; L169-L191 HydrophobicContact CD2-CG 4.42Å |
| 170 | S | 92.9 | Very high | 91.1 | Very high | 62 Ų | 62 | 38.3 Ų | 38.3 | 43% | 0.434 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -61.7 | -44.4 | 174.8 | -58 | 0 | 0 | 0 | 0 | 111.7 | C166 D167 Q173 A174 | C166-S170 WeakPolarHBondContact O-CB 3.36Å; C166-S170 PolarHBondContact O-OG 3.39Å; D167-S170 PolarHBondContact O-N 3.37Å; S170-Q173 PolarHBondContact O-N 3.22Å; S170-A174 WeakPolarHBondContact O-CB 3.14Å; S170-A174 PolarHBondContact O-N 3.22Å |
| 171 | M | 92.8 | Very high | 89.7 | Confident | 56 Ų | 56 | 41.7 Ų | 41.7 | 28% | 0.276 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.4 | -39.1 | 176.7 | -72.4 | -57 | -60.2 | 0 | 0 | 112.5 | V95 L101 L106 D167 V168 A174 I175 | V95-M171 HydrophobicContact CG1-CB 3.84Å; V95-M171 HydrophobicContact CG1-CG 4.35Å; V95-M171 HydrophobicContact CG2-CB 4.27Å; L101-M171 HydrophobicContact CD1-CE 3.43Å; L101-M171 VanDerWaalsContact CD1-CE 3.43Å; L101-M171 HydrophobicContact CG-CE 3.9Å; L106-M171 HydrophobicContact CD1-CE 4.43Å; D167-M171 WeakPolarHBondContact O-CB 3.37Å; D167-M171 VanDerWaalsContact O-CG 3.27Å; D167-M171 WeakPolarHBondContact O-CG 3.43Å; D167-M171 PolarHBondContact O-N 3.35Å; V168-M171 PolarHBondContact O-N 2.94Å; M171-A174 PolarHBondContact O-N 3.35Å; M171-I175 WeakPolarHBondContact O-CB 3.32Å; M171-I175 VanDerWaalsContact O-CG1 3.25Å; M171-I175 WeakPolarHBondContact O-CG1 3.46Å; M171-I175 PolarHBondContact O-N 3.07Å |
| 172 | L | 92.4 | Very high | 88.5 | Confident | 2 Ų | 2 | 45.8 Ų | 45.8 | 1% | 0.01 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.8 | -45 | 171.7 | -76.5 | 170.1 | 0 | 0 | 0 | 111.4 | V92 F96 L134 V168 L169 A174 I175 F176 V186 A190 | V92-L172 HydrophobicContact CG1-CD2 3.67Å; V92-L172 HydrophobicContact CG2-CD2 4.09Å; F96-L172 HydrophobicContact CE2-CD1 4.17Å; F96-L172 HydrophobicContact CE2-CD2 4.49Å; F96-L172 HydrophobicContact CZ-CD1 4.12Å; L134-L172 HydrophobicContact CD2-CD1 4.05Å; V168-L172 HydrophobicContact CG1-CD1 3.92Å; V168-L172 HydrophobicContact CG1-CG 4.33Å; V168-L172 WeakPolarHBondContact O-CB 3.45Å; V168-L172 VanDerWaalsContact O-CG 3.24Å; V168-L172 WeakPolarHBondContact O-CG 3.26Å; V168-L172 PolarHBondContact O-N 2.83Å; L169-L172 PolarHBondContact O-N 2.96Å; L172-A174 VanDerWaalsContact C-N 3.28Å; L172-A174 PolarHBondContact O-N 3.04Å; L172-I175 PolarHBondContact O-N 2.87Å; L172-F176 HydrophobicContact CD2-CD2 4.17Å; L172-F176 HydrophobicContact CD2-CE2 3.75Å; L172-F176 WeakPolarHBondContact O-CB 3.41Å; L172-F176 VanDerWaalsContact O-CD2 3.26Å; L172-F176 WeakPolarHBondContact O-CD2 3.37Å; L172-F176 PolarHBondContact O-N 2.98Å; L172-V186 HydrophobicContact CB-CG1 4.31Å; L172-A190 HydrophobicContact CD1-CB 4.31Å |
| 173 | Q | 92.2 | Very high | 86.9 | Confident | 74 Ų | 74 | 52 Ų | 52 | 35% | 0.346 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.8 | -33.4 | 175.9 | -71 | -176.1 | -109.5 | 0 | 0 | 112 | L169 S170 H177 | L169-Q173 WeakPolarHBondContact O-CB 3.38Å; L169-Q173 VanDerWaalsContact O-CG 3.3Å; L169-Q173 WeakPolarHBondContact O-CG 3.31Å; L169-Q173 PolarHBondContact O-N 3.15Å; S170-Q173 PolarHBondContact O-N 3.22Å; Q173-H177 PolarHBondContact O-N 3.44Å; Q173-H177 VanDerWaalsContact O-N 3.1Å |
| 174 | A | 91.3 | Very high | 85.9 | Confident | 32 Ų | 32 | 54.2 Ų | 54.2 | 26% | 0.264 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -76.2 | -37.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | L106 N110 S170 M171 L172 | L106-A174 HydrophobicContact CD1-CB 4.08Å; L106-A174 HydrophobicContact CD2-CB 4.25Å; N110-A174 PolarHBondContact ND2-O 3.48Å; N110-A174 PolarHBondContact OD1-O 3.48Å; S170-A174 WeakPolarHBondContact O-CB 3.14Å; S170-A174 PolarHBondContact O-N 3.22Å; M171-A174 PolarHBondContact O-N 3.35Å; L172-A174 VanDerWaalsContact C-N 3.28Å; L172-A174 PolarHBondContact O-N 3.04Å |
| 175 | I | 90.3 | Very high | 85.4 | Confident | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -70.4 | -38.4 | 175.4 | -67.9 | 164.2 | 0 | 0 | 0 | 110.6 | I88 V92 L101 L106 L109 N110 V113 M171 L172 | I88-I175 HydrophobicContact CG2-CG2 4.41Å; V92-I175 HydrophobicContact CG2-CD1 3.92Å; L101-I175 HydrophobicContact CD1-CD1 4.22Å; L101-I175 HydrophobicContact CD1-CG1 4.44Å; L106-I175 HydrophobicContact CD1-CB 4.46Å; L106-I175 HydrophobicContact CD1-CG1 3.66Å; L109-I175 HydrophobicContact CB-CG2 4.34Å; L109-I175 HydrophobicContact CD1-CD1 4.34Å; L109-I175 HydrophobicContact CD1-CG1 4.2Å; N110-I175 PolarHBondContact OD1-O 2.99Å; V113-I175 HydrophobicContact CG2-CG2 4.46Å; M171-I175 WeakPolarHBondContact O-CB 3.32Å; M171-I175 VanDerWaalsContact O-CG1 3.25Å; M171-I175 WeakPolarHBondContact O-CG1 3.46Å; M171-I175 PolarHBondContact O-N 3.07Å; L172-I175 PolarHBondContact O-N 2.87Å |
| 176 | F | 90 | Very high | 85.2 | Confident | 3 Ų | 3 | 56.3 Ų | 56.3 | 1% | 0.013 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | 20.4 | -176.5 | -59.5 | -54.2 | 0 | 0 | 0 | 114 | I88 V92 V113 F125 L129 L133 L172 P178 V179 V186 | I88-F176 HydrophobicContact CG2-CE1 3.72Å; I88-F176 HydrophobicContact CG2-CZ 3.8Å; V92-F176 HydrophobicContact CG2-CE2 4.03Å; V92-F176 HydrophobicContact CG2-CZ 3.99Å; V113-F176 HydrophobicContact CG1-CD1 4.19Å; V113-F176 HydrophobicContact CG2-CD1 3.79Å; V113-F176 HydrophobicContact CG2-CE1 3.8Å; F125-F176 HydrophobicContact CE1-CD1 4.44Å; F125-F176 HydrophobicContact CE2-CD1 4.22Å; F125-F176 HydrophobicContact CE2-CE1 4.04Å; F125-F176 AromaticContact CZ-CD1 3.49Å; F125-F176 HydrophobicContact CZ-CD1 3.49Å; F125-F176 VanDerWaalsContact CZ-CD1 3.49Å; F125-F176 AromaticContact CZ-CE1 3.6Å; F125-F176 HydrophobicContact CZ-CE1 3.6Å; F125-F176 HydrophobicContact CZ-CG 4.22Å; F125-F176 HydrophobicContact CZ-CZ 4.4Å; L129-F176 HydrophobicContact CD1-CD2 4.06Å; L129-F176 HydrophobicContact CD1-CE2 3.58Å; L129-F176 HydrophobicContact CD1-CZ 4.04Å; L133-F176 HydrophobicContact CD2-CE2 4.02Å; L133-F176 HydrophobicContact CD2-CZ 3.54Å; L172-F176 HydrophobicContact CD2-CD2 4.17Å; L172-F176 HydrophobicContact CD2-CE2 3.75Å; L172-F176 WeakPolarHBondContact O-CB 3.41Å; L172-F176 VanDerWaalsContact O-CD2 3.26Å; L172-F176 WeakPolarHBondContact O-CD2 3.37Å; L172-F176 PolarHBondContact O-N 2.98Å; F176-P178 VanDerWaalsContact C-N 3.27Å; F176-V179 HydrophobicContact CB-CG2 3.89Å; F176-V179 HydrophobicContact CD1-CG2 4.26Å; F176-V179 HydrophobicContact CG-CG2 4.5Å; F176-V179 WeakPolarHBondContact O-CB 3.4Å; F176-V179 WeakPolarHBondContact O-CG2 3.3Å; F176-V179 PolarHBondContact O-N 3.25Å; F176-V186 HydrophobicContact CB-CG1 4.36Å; F176-V186 HydrophobicContact CB-CG2 3.86Å; F176-V186 HydrophobicContact CD2-CG1 4.16Å |
| 177 | H | 88.8 | Confident | 85.1 | Confident | 104 Ų | 104 | 57 Ų | 57 | 48% | 0.481 | 32% | 0.317 | S | S | . | . | G | 310 helix | trans | -49.4 | -38.1 | 170.7 | -169.7 | -59.5 | 0 | 0 | 0 | 113.8 | Q173 V179 Q180 | Q173-H177 PolarHBondContact O-N 3.44Å; Q173-H177 VanDerWaalsContact O-N 3.1Å; H177-V179 PolarHBondContact O-N 2.98Å; H177-V179 VanDerWaalsContact O-N 3.14Å; H177-Q180 PolarHBondContact CD2-NE2 3.34Å; H177-Q180 PolarHBondContact CE1-NE2 2.9Å; H177-Q180 VanDerWaalsContact CE1-NE2 3.34Å; H177-Q180 PolarHBondContact CE1-OE1 3.3Å; H177-Q180 VanDerWaalsContact CE1-OE1 3.28Å; H177-Q180 PolarHBondContact NE2-NE2 3.47Å; H177-Q180 VanDerWaalsContact NE2-NE2 3.14Å; H177-Q180 VanDerWaalsContact O-CG 3.24Å; H177-Q180 WeakPolarHBondContact O-CG 3.4Å; H177-Q180 PolarHBondContact O-N 2.74Å |
| 178 | P | 85.8 | Confident | 84.9 | Confident | 34 Ų | 34 | 55.5 Ų | 55.5 | 22% | 0.221 | 31% | 0.307 | C | S | . | . | G | 310 helix | trans | -71.2 | -6 | 179.9 | -16.9 | 32.8 | 0 | 0 | 0 | 114.1 | N110 V113 R114 L117 F176 | N110-P178 HydrophobicContact CB-CG 4.46Å; N110-P178 WeakPolarHBondContact OD1-CD 3.15Å; N110-P178 WeakPolarHBondContact OD1-CG 3.38Å; V113-P178 HydrophobicContact CB-CG 4.3Å; V113-P178 HydrophobicContact CG1-CB 4.13Å; V113-P178 HydrophobicContact CG1-CG 4.08Å; R114-P178 HydrophobicContact CB-CB 4.14Å; R114-P178 HydrophobicContact CB-CG 4.45Å; R114-P178 HydrophobicContact CG-CB 4.25Å; L117-P178 HydrophobicContact CD1-CB 4.16Å; L117-P178 VanDerWaalsContact CD1-O 3.24Å; L117-P178 WeakPolarHBondContact CD1-O 3.44Å; F176-P178 VanDerWaalsContact C-N 3.27Å |
| 179 | V | 82.3 | Confident | 84.7 | Confident | 12 Ų | 12 | 55.9 Ų | 55.9 | 7% | 0.073 | 31% | 0.309 | C | S | . | . | G | 310 helix | trans | -94 | -1.7 | 179.9 | -159.8 | 0 | 0 | 0 | 0 | 112 | V113 L117 F125 F176 H177 G181 K182 | V113-V179 HydrophobicContact CG1-CG2 3.75Å; L117-V179 HydrophobicContact CD1-CG2 4.03Å; L117-V179 HydrophobicContact CD2-CG1 4.44Å; L117-V179 HydrophobicContact CD2-CG2 4.49Å; F125-V179 HydrophobicContact CD1-CG1 3.79Å; F125-V179 HydrophobicContact CD1-CG2 4.27Å; F125-V179 HydrophobicContact CE1-CB 4.29Å; F125-V179 HydrophobicContact CE1-CG1 3.7Å; F125-V179 HydrophobicContact CE1-CG2 3.61Å; F125-V179 HydrophobicContact CZ-CG2 3.77Å; F176-V179 HydrophobicContact CB-CG2 3.89Å; F176-V179 HydrophobicContact CD1-CG2 4.26Å; F176-V179 HydrophobicContact CG-CG2 4.5Å; F176-V179 WeakPolarHBondContact O-CB 3.4Å; F176-V179 WeakPolarHBondContact O-CG2 3.3Å; F176-V179 PolarHBondContact O-N 3.25Å; H177-V179 PolarHBondContact O-N 2.98Å; H177-V179 VanDerWaalsContact O-N 3.14Å; V179-G181 PolarHBondContact O-N 2.99Å; V179-K182 HydrophobicContact CG1-CD 4.27Å; V179-K182 PolarHBondContact O-N 3.41Å |
| 180 | Q | 70.5 | Confident | 84.6 | Confident | 136 Ų | 136 | 55.9 Ų | 55.9 | 64% | 0.636 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.7 | 132.8 | 178.9 | -74.8 | 170 | 6 | 0 | 0 | 111.8 | H177 | H177-Q180 PolarHBondContact CD2-NE2 3.34Å; H177-Q180 PolarHBondContact CE1-NE2 2.9Å; H177-Q180 VanDerWaalsContact CE1-NE2 3.34Å; H177-Q180 PolarHBondContact CE1-OE1 3.3Å; H177-Q180 VanDerWaalsContact CE1-OE1 3.28Å; H177-Q180 PolarHBondContact NE2-NE2 3.47Å; H177-Q180 VanDerWaalsContact NE2-NE2 3.14Å; H177-Q180 VanDerWaalsContact O-CG 3.24Å; H177-Q180 WeakPolarHBondContact O-CG 3.4Å; H177-Q180 PolarHBondContact O-N 2.74Å |
| 181 | G | 67.1 | Low | 84.6 | Confident | 85 Ų | 85 | 53.1 Ų | 53.1 | 88% | 0.876 | 29% | 0.29 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 102.7 | -7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | V179 | V179-G181 PolarHBondContact O-N 2.99Š|
| 182 | K | 68.3 | Low | 84.4 | Confident | 87 Ų | 87 | 51.6 Ų | 51.6 | 38% | 0.378 | 28% | 0.282 | S | S | . | . | P | Polyproline II helix | trans | -91.1 | 125.6 | 166.4 | -65.2 | -170.1 | 178.8 | -172.1 | 0 | 110.7 | G122 V179 P184 | G122-K182 PolarHBondContact O-NZ 2.95Å; V179-K182 HydrophobicContact CG1-CD 4.27Å; V179-K182 PolarHBondContact O-N 3.41Å; K182-P184 CarbonylContact O-C 3.44Å |
| 183 | E | 62.3 | Low | 84.3 | Confident | 189 Ų | 189 | 52.7 Ų | 52.7 | 88% | 0.883 | 29% | 0.288 | S | S | * | . | S | Bend | trans | -87.3 | 141.3 | 164.1 | -65.1 | -165.6 | 149.6 | 0 | 0 | 110.3 | ||
| 184 | P | 73.7 | Confident | 84.3 | Confident | 65 Ų | 65 | 49.2 Ų | 49.2 | 42% | 0.422 | 27% | 0.271 | S | S | . | . | S | Bend | cis | -72.4 | 146 | -5.3 | 31.4 | -35.7 | 0 | 0 | 0 | 112.4 | K182 L189 | K182-P184 CarbonylContact O-C 3.44Å; P184-L189 HydrophobicContact CG-CD1 4.05Å |
| 185 | S | 85.3 | Confident | 84.2 | Confident | 60 Ų | 60 | 47.8 Ų | 47.8 | 42% | 0.42 | 26% | 0.259 | S | S | . | . | P | Polyproline II helix | trans | -65.3 | 149.9 | 179.1 | 75.4 | 0 | 0 | 0 | 0 | 112.2 | R187 Q188 L189 | S185-R187 PolarHBondContact O-N 3.32Å; S185-R187 VanDerWaalsContact O-N 3.11Å; S185-Q188 PolarHBondContact O-N 2.87Å; S185-Q188 VanDerWaalsContact O-N 3.09Å; S185-Q188 WeakPolarHBondContact OG-CB 3.44Å; S185-Q188 PolarHBondContact OG-N 3.46Å; S185-Q188 VanDerWaalsContact OG-N 3.14Å; S185-L189 WeakPolarHBondContact O-CB 3.49Å; S185-L189 PolarHBondContact O-N 3.39Å |
| 186 | V | 88.4 | Confident | 84.1 | Confident | 21 Ų | 21 | 50.2 Ų | 50.2 | 13% | 0.127 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -51.4 | -37.5 | 175.8 | 177.7 | 0 | 0 | 0 | 0 | 111.5 | L129 L172 F176 A190 | L129-V186 HydrophobicContact CD2-CG1 4.3Å; L129-V186 HydrophobicContact CD2-CG2 4Å; L172-V186 HydrophobicContact CB-CG1 4.31Å; F176-V186 HydrophobicContact CB-CG1 4.36Å; F176-V186 HydrophobicContact CB-CG2 3.86Å; F176-V186 HydrophobicContact CD2-CG1 4.16Å; V186-A190 VanDerWaalsContact O-CB 3.3Å; V186-A190 WeakPolarHBondContact O-CB 3.35Å; V186-A190 PolarHBondContact O-N 3.38Å |
| 187 | R | 90.9 | Very high | 84 | Confident | 87 Ų | 87 | 51.5 Ų | 51.5 | 33% | 0.328 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -66.6 | -52.1 | 177.3 | 179.4 | 175.9 | -179 | 87.3 | 3.4 | 112.3 | L169 S185 L189 A190 L191 | L169-R187 HydrophobicContact CD1-CB 4.44Å; L169-R187 HydrophobicContact CD1-CG 4.27Å; L169-R187 HydrophobicContact CD2-CG 4.45Å; S185-R187 PolarHBondContact O-N 3.32Å; S185-R187 VanDerWaalsContact O-N 3.11Å; R187-L189 PolarHBondContact O-N 3.43Å; R187-A190 PolarHBondContact O-N 3.48Å; R187-L191 HydrophobicContact CG-CD1 3.85Å; R187-L191 WeakPolarHBondContact O-CB 3.46Å; R187-L191 WeakPolarHBondContact O-CG 3.49Å; R187-L191 PolarHBondContact O-N 2.74Å |
| 188 | Q | 89.6 | Confident | 83.8 | Confident | 57 Ų | 57 | 46.6 Ų | 46.6 | 27% | 0.266 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -55.9 | -45.9 | 177.3 | -173.9 | 71.2 | -4.7 | 0 | 0 | 110.3 | S185 L191 L192 V229 H230 | S185-Q188 PolarHBondContact O-N 2.87Å; S185-Q188 VanDerWaalsContact O-N 3.09Å; S185-Q188 WeakPolarHBondContact OG-CB 3.44Å; S185-Q188 PolarHBondContact OG-N 3.46Å; S185-Q188 VanDerWaalsContact OG-N 3.14Å; Q188-L191 PolarHBondContact O-N 2.91Å; Q188-L192 VanDerWaalsContact O-CB 3.26Å; Q188-L192 WeakPolarHBondContact O-CB 3.28Å; Q188-L192 PolarHBondContact O-N 2.67Å; Q188-V229 HydrophobicContact CG-CG1 4.46Å; Q188-H230 PolarHBondContact NE2-O 3Å |
| 189 | L | 89.6 | Confident | 83.5 | Confident | 7 Ų | 7 | 45.1 Ų | 45.1 | 4% | 0.037 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.3 | -43.1 | -176.5 | -166.1 | 73.8 | 0 | 0 | 0 | 112.8 | L129 Q130 L134 P184 S185 R187 L192 H193 | L129-L189 HydrophobicContact CB-CD2 4.36Å; L129-L189 HydrophobicContact CD2-CD2 3.69Å; L129-L189 HydrophobicContact CG-CD2 3.85Å; Q130-L189 HydrophobicContact CG-CD1 3.38Å; Q130-L189 HydrophobicContact CG-CD2 3.43Å; Q130-L189 VanDerWaalsContact CG-CD2 3.43Å; Q130-L189 HydrophobicContact CG-CG 3.67Å; L134-L189 HydrophobicContact CD1-CB 4.17Å; L134-L189 HydrophobicContact CD1-CD2 3.58Å; L134-L189 HydrophobicContact CD1-CG 3.58Å; P184-L189 HydrophobicContact CG-CD1 4.05Å; S185-L189 WeakPolarHBondContact O-CB 3.49Å; S185-L189 PolarHBondContact O-N 3.39Å; R187-L189 PolarHBondContact O-N 3.43Å; L189-L192 PolarHBondContact O-N 3.3Å; L189-H193 PolarHBondContact O-N 3.36Å; L189-H193 PolarHBondContact O-ND1 2.91Å |
| 190 | A | 92.1 | Very high | 83.4 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.4 | -43.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L134 M138 F164 L169 L172 V186 R187 L192 H193 F194 | L134-A190 HydrophobicContact CD1-CB 4.46Å; L134-A190 HydrophobicContact CD2-CB 3.86Å; M138-A190 WeakPolarHBondContact CE-O 3.38Å; F164-A190 HydrophobicContact CZ-CB 4.01Å; L169-A190 HydrophobicContact CD1-CB 3.88Å; L172-A190 HydrophobicContact CD1-CB 4.31Å; V186-A190 VanDerWaalsContact O-CB 3.3Å; V186-A190 WeakPolarHBondContact O-CB 3.35Å; V186-A190 PolarHBondContact O-N 3.38Å; R187-A190 PolarHBondContact O-N 3.48Å; A190-L192 VanDerWaalsContact C-N 3.33Å; A190-L192 PolarHBondContact O-N 2.99Å; A190-H193 PolarHBondContact O-N 3.48Å; A190-F194 PolarHBondContact O-N 3.43Å |
| 191 | L | 92.5 | Very high | 83.6 | Confident | 5 Ų | 5 | 42.3 Ų | 42.3 | 3% | 0.026 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.7 | -41.3 | 175.4 | -70.6 | 167.1 | 0 | 0 | 0 | 111.6 | W161 F164 F165 L169 R187 Q188 F194 R195 I225 L226 V229 | W161-L191 HydrophobicContact CH2-CD2 3.67Å; W161-L191 HydrophobicContact CZ3-CD2 4.04Å; F164-L191 HydrophobicContact CE1-CD2 4.2Å; F165-L191 HydrophobicContact CD2-CD2 4.32Å; F165-L191 HydrophobicContact CE2-CD2 4.47Å; L169-L191 HydrophobicContact CD2-CD2 4.22Å; L169-L191 HydrophobicContact CD2-CG 4.42Å; R187-L191 HydrophobicContact CG-CD1 3.85Å; R187-L191 WeakPolarHBondContact O-CB 3.46Å; R187-L191 WeakPolarHBondContact O-CG 3.49Å; R187-L191 PolarHBondContact O-N 2.74Å; Q188-L191 PolarHBondContact O-N 2.91Å; L191-F194 WeakPolarHBondContact O-CB 3.49Å; L191-F194 PolarHBondContact O-N 3.31Å; L191-R195 PolarHBondContact O-N 2.74Å; L191-I225 HydrophobicContact CD1-CG2 4.41Å; L191-I225 HydrophobicContact CD2-CG2 4.15Å; L191-L226 HydrophobicContact CB-CD2 4Å; L191-L226 HydrophobicContact CD2-CD2 4.01Å; L191-L226 WeakPolarHBondContact O-CD2 3.38Å; L191-V229 HydrophobicContact CB-CB 4.5Å; L191-V229 HydrophobicContact CB-CG1 3.95Å; L191-V229 HydrophobicContact CB-CG2 3.89Å; L191-V229 HydrophobicContact CD1-CG2 3.87Å; L191-V229 HydrophobicContact CG-CG2 4.47Å |
| 192 | L | 89.9 | Confident | 84.2 | Confident | 23 Ų | 23 | 39.4 Ų | 39.4 | 12% | 0.12 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.4 | -44.9 | 176.9 | -170.6 | 75.7 | 0 | 0 | 0 | 112.2 | Q188 L189 A190 F194 R195 N196 V229 E231 | Q188-L192 VanDerWaalsContact O-CB 3.26Å; Q188-L192 WeakPolarHBondContact O-CB 3.28Å; Q188-L192 PolarHBondContact O-N 2.67Å; L189-L192 PolarHBondContact O-N 3.3Å; A190-L192 VanDerWaalsContact C-N 3.33Å; A190-L192 PolarHBondContact O-N 2.99Å; L192-F194 VanDerWaalsContact C-N 3.3Å; L192-F194 PolarHBondContact O-N 3.05Å; L192-R195 WeakPolarHBondContact O-CB 3.26Å; L192-R195 PolarHBondContact O-N 2.7Å; L192-N196 PolarHBondContact O-N 3.14Å; L192-V229 HydrophobicContact CB-CG1 4.08Å; L192-V229 HydrophobicContact CD1-CG1 4.16Å; L192-E231 HydrophobicContact CD1-CG 3.41Å; L192-E231 VanDerWaalsContact CD1-CG 3.41Å; L192-E231 HydrophobicContact CD2-CG 3.77Å; L192-E231 HydrophobicContact CG-CG 4.17Å |
| 193 | H | 89.6 | Confident | 84.8 | Confident | 26 Ų | 26 | 40.6 Ų | 40.6 | 12% | 0.12 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.4 | -34 | 176 | -79.5 | 67.8 | 0 | 0 | 0 | 111.9 | L134 M138 L189 A190 T197 | L134-H193 HydrophobicContact CB-CB 4.1Å; L134-H193 HydrophobicContact CD1-CB 4.48Å; M138-H193 HydrophobicContact CE-CB 3.98Å; M138-H193 HydrophobicContact CG-CB 3.91Å; L189-H193 PolarHBondContact O-N 3.36Å; L189-H193 PolarHBondContact O-ND1 2.91Å; A190-H193 PolarHBondContact O-N 3.48Å; H193-T197 WeakPolarHBondContact O-CB 3.21Å; H193-T197 PolarHBondContact O-N 3.28Å; H193-T197 PolarHBondContact O-OG1 3.13Å |
| 194 | F | 91.9 | Very high | 85.8 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63.8 | -48.6 | 172.5 | -170.7 | -75.8 | 0 | 0 | 0 | 111.1 | M138 L157 W161 F164 A190 L191 L192 N196 I198 V199 M222 L226 | M138-F194 HydrophobicContact CE-CB 3.89Å; M138-F194 HydrophobicContact SD-CB 4.01Å; M138-F194 HydrophobicContact SD-CD2 4.09Å; M138-F194 HydrophobicContact SD-CG 4.47Å; L157-F194 HydrophobicContact CD1-CZ 4.36Å; W161-F194 HydrophobicContact CB-CZ 4.38Å; W161-F194 HydrophobicContact CE3-CD1 4.16Å; W161-F194 HydrophobicContact CE3-CD2 4.41Å; W161-F194 AromaticContact CE3-CE1 3.79Å; W161-F194 HydrophobicContact CE3-CE1 3.79Å; W161-F194 HydrophobicContact CE3-CE2 4.04Å; W161-F194 HydrophobicContact CE3-CG 4.48Å; W161-F194 AromaticContact CE3-CZ 3.73Å; W161-F194 HydrophobicContact CE3-CZ 3.73Å; W161-F194 HydrophobicContact CZ3-CD1 4.15Å; W161-F194 HydrophobicContact CZ3-CE1 4.23Å; W161-F194 HydrophobicContact CZ3-CG 4.37Å; W161-F194 HydrophobicContact CZ3-CZ 4.5Å; F164-F194 HydrophobicContact CB-CD2 4.14Å; F164-F194 HydrophobicContact CB-CE2 3.88Å; F164-F194 HydrophobicContact CD1-CB 4.42Å; F164-F194 AromaticContact CD1-CD2 3.28Å; F164-F194 HydrophobicContact CD1-CD2 3.28Å; F164-F194 AromaticContact CD1-CE2 3.72Å; F164-F194 HydrophobicContact CD1-CE2 3.72Å; F164-F194 AromaticContact CD1-CG 3.99Å; F164-F194 HydrophobicContact CD1-CG 3.99Å; F164-F194 HydrophobicContact CD2-CD2 4.09Å; F164-F194 HydrophobicContact CE1-CB 3.89Å; F164-F194 AromaticContact CE1-CD2 3.64Å; F164-F194 HydrophobicContact CE1-CD2 3.64Å; F164-F194 HydrophobicContact CE1-CE2 4.49Å; F164-F194 AromaticContact CE1-CG 3.95Å; F164-F194 HydrophobicContact CE1-CG 3.95Å; F164-F194 HydrophobicContact CE2-CD2 4.4Å; F164-F194 AromaticContact CG-CD2 3.53Å; F164-F194 HydrophobicContact CG-CD2 3.53Å; F164-F194 AromaticContact CG-CE2 3.8Å; F164-F194 HydrophobicContact CG-CE2 3.8Å; F164-F194 HydrophobicContact CZ-CB 4.15Å; F164-F194 HydrophobicContact CZ-CD2 4.19Å; A190-F194 PolarHBondContact O-N 3.43Å; L191-F194 WeakPolarHBondContact O-CB 3.49Å; L191-F194 PolarHBondContact O-N 3.31Å; L192-F194 VanDerWaalsContact C-N 3.3Å; L192-F194 PolarHBondContact O-N 3.05Å; F194-N196 PolarHBondContact O-N 3.49Å; F194-I198 HydrophobicContact CD1-CB 4.42Å; F194-I198 HydrophobicContact CD2-CD1 3.55Å; F194-I198 HydrophobicContact CE1-CB 4.25Å; F194-I198 HydrophobicContact CE1-CG2 4.21Å; F194-I198 HydrophobicContact CE2-CD1 3.52Å; F194-I198 HydrophobicContact CG-CD1 4.09Å; F194-I198 HydrophobicContact CZ-CB 4.4Å; F194-I198 HydrophobicContact CZ-CD1 4.02Å; F194-I198 HydrophobicContact CZ-CG2 4.12Å; F194-I198 WeakPolarHBondContact O-CA 3.4Å; F194-I198 WeakPolarHBondContact O-CB 3.36Å; F194-I198 PolarHBondContact O-N 3.38Å; F194-V199 HydrophobicContact CD1-CG2 3.97Å; F194-V199 HydrophobicContact CE1-CG2 3.78Å; F194-V199 PolarHBondContact O-N 2.74Å; F194-M222 HydrophobicContact CE1-CG 4.19Å; F194-M222 HydrophobicContact CE1-SD 3.55Å; F194-M222 VanDerWaalsContact CE1-SD 3.55Å; F194-M222 HydrophobicContact CZ-SD 4.03Å; F194-L226 HydrophobicContact CD1-CD1 3.93Å; F194-L226 HydrophobicContact CE1-CD1 4.37Å |
| 195 | R | 90 | Very high | 86.3 | Confident | 3 Ų | 3 | 32.8 Ų | 32.8 | 1% | 0.011 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -54 | -56.3 | 175.7 | -169.9 | -166.4 | 72.9 | -167 | 8.4 | 111.1 | L191 L192 V199 L200 L226 V229 E231 L242 | L191-R195 PolarHBondContact O-N 2.74Å; L192-R195 WeakPolarHBondContact O-CB 3.26Å; L192-R195 PolarHBondContact O-N 2.7Å; R195-V199 WeakPolarHBondContact O-CB 3.3Å; R195-V199 PolarHBondContact O-N 3.14Å; R195-L200 HydrophobicContact CG-CD1 4.45Å; R195-L200 PolarHBondContact O-N 2.99Å; R195-L226 HydrophobicContact CB-CD1 4.34Å; R195-L226 HydrophobicContact CB-CD2 4.32Å; R195-V229 PolarHBondContact NH1-O 2.9Å; R195-E231 IonicContact CZ-OE1 2.81Å; R195-E231 IonicContact NH2-OE1 3.83Å; R195-E231 PolarHBondContact NH2-OE1 3.32Å; R195-L242 HydrophobicContact CG-CD2 4.16Å |
| 196 | N | 88.6 | Confident | 86.4 | Confident | 51 Ų | 51 | 34.7 Ų | 34.7 | 27% | 0.273 | 18% | 0.175 | S | C | . | . | I | π-helix | trans | -71.9 | -34.8 | -172.7 | -64.8 | -3.2 | 0 | 0 | 0 | 112.6 | L192 F194 E231 | L192-N196 PolarHBondContact O-N 3.14Å; F194-N196 PolarHBondContact O-N 3.49Å; N196-E231 PolarHBondContact ND2-OE1 2.99Å; N196-E231 VanDerWaalsContact ND2-OE1 3.09Å |
| 197 | T | 86 | Confident | 86.2 | Confident | 29 Ų | 29 | 33.8 Ų | 33.8 | 18% | 0.178 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -92.5 | -23.8 | -174.7 | -44.8 | 0 | 0 | 0 | 0 | 113.7 | M138 V139 R142 H193 S201 | M138-T197 HydrophobicContact CB-CG2 3.64Å; V139-T197 HydrophobicContact CG2-CG2 4.48Å; R142-T197 WeakPolarHBondContact CD-O 3.26Å; H193-T197 WeakPolarHBondContact O-CB 3.21Å; H193-T197 PolarHBondContact O-N 3.28Å; H193-T197 PolarHBondContact O-OG1 3.13Å; T197-S201 WeakPolarHBondContact O-CB 3.41Å; T197-S201 PolarHBondContact O-OG 2.92Å |
| 198 | I | 84.9 | Confident | 85.9 | Confident | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.005 | 16% | 0.158 | C | C | . | . | I | π-helix | trans | -117.1 | -61.9 | -174.8 | -61.5 | 167.7 | 0 | 0 | 0 | 110.1 | M138 L141 R142 I145 L157 F194 L200 S201 V202 | M138-I198 HydrophobicContact SD-CD1 4.06Å; L141-I198 HydrophobicContact CB-CD1 3.75Å; L141-I198 HydrophobicContact CD1-CD1 4.33Å; R142-I198 HydrophobicContact CB-CG1 4.05Å; I145-I198 HydrophobicContact CD1-CG2 3.82Å; L157-I198 HydrophobicContact CD1-CG2 3.95Å; F194-I198 HydrophobicContact CD1-CB 4.42Å; F194-I198 HydrophobicContact CD2-CD1 3.55Å; F194-I198 HydrophobicContact CE1-CB 4.25Å; F194-I198 HydrophobicContact CE1-CG2 4.21Å; F194-I198 HydrophobicContact CE2-CD1 3.52Å; F194-I198 HydrophobicContact CG-CD1 4.09Å; F194-I198 HydrophobicContact CZ-CB 4.4Å; F194-I198 HydrophobicContact CZ-CD1 4.02Å; F194-I198 HydrophobicContact CZ-CG2 4.12Å; F194-I198 WeakPolarHBondContact O-CA 3.4Å; F194-I198 WeakPolarHBondContact O-CB 3.36Å; F194-I198 PolarHBondContact O-N 3.38Å; I198-L200 PolarHBondContact O-N 3.39Å; I198-S201 PolarHBondContact O-N 2.74Å; I198-V202 HydrophobicContact CG2-CG2 4.43Å; I198-V202 WeakPolarHBondContact O-CB 3.32Å; I198-V202 WeakPolarHBondContact O-CG2 3.42Å; I198-V202 PolarHBondContact O-N 3.48Å |
| 199 | V | 80.9 | Confident | 85.7 | Confident | 3 Ų | 3 | 30.6 Ų | 30.6 | 2% | 0.018 | 17% | 0.166 | C | C | . | . | I | π-helix | trans | -62.6 | -42.6 | -174.3 | -179.9 | 0 | 0 | 0 | 0 | 112.2 | F194 R195 L204 M222 L223 L226 L242 L245 | F194-V199 HydrophobicContact CD1-CG2 3.97Å; F194-V199 HydrophobicContact CE1-CG2 3.78Å; F194-V199 PolarHBondContact O-N 2.74Å; R195-V199 WeakPolarHBondContact O-CB 3.3Å; R195-V199 PolarHBondContact O-N 3.14Å; V199-L204 HydrophobicContact CG1-CD2 3.97Å; V199-M222 HydrophobicContact CG2-CE 3.99Å; V199-M222 HydrophobicContact CG2-SD 4.17Å; V199-L223 HydrophobicContact CG1-CD2 3.99Å; V199-L226 HydrophobicContact CG2-CD1 3.63Å; V199-L242 HydrophobicContact CG1-CD1 3.9Å; V199-L245 HydrophobicContact CG1-CD1 3.77Å |
| 200 | L | 79.1 | Confident | 85.6 | Confident | 27 Ų | 27 | 36.8 Ų | 36.8 | 14% | 0.141 | 19% | 0.189 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88.8 | -2.5 | -179.3 | -61.4 | 179.1 | 0 | 0 | 0 | 114.8 | R195 I198 D238 R241 | R195-L200 HydrophobicContact CG-CD1 4.45Å; R195-L200 PolarHBondContact O-N 2.99Å; I198-L200 PolarHBondContact O-N 3.39Å; L200-D238 HydrophobicContact CD1-CB 3.6Å; L200-D238 WeakPolarHBondContact CD1-O 3.43Å; L200-R241 HydrophobicContact CD2-CB 3.89Å |
| 201 | S | 74.1 | Confident | 84.5 | Confident | 63 Ų | 63 | 43.1 Ų | 43.1 | 44% | 0.441 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -111.9 | -27.6 | -178.4 | 87 | 0 | 0 | 0 | 0 | 114.1 | R142 T197 I198 | R142-S201 WeakPolarHBondContact CD-OG 3.28Å; T197-S201 WeakPolarHBondContact O-CB 3.41Å; T197-S201 PolarHBondContact O-OG 2.92Å; I198-S201 PolarHBondContact O-N 2.74Å |
| 202 | V | 80 | Confident | 83.6 | Confident | 23 Ų | 23 | 54 Ų | 54 | 14% | 0.139 | 27% | 0.27 | C | S | . | . | S | Bend | trans | -88.9 | 152.1 | 176.6 | -171.3 | 0 | 0 | 0 | 0 | 108.7 | R142 I145 L153 I198 L204 | R142-V202 HydrophobicContact CG-CG2 4.14Å; I145-V202 HydrophobicContact CD1-CG2 4.48Å; I145-V202 HydrophobicContact CG1-CG2 4.41Å; L153-V202 HydrophobicContact CD1-CG1 3.57Å; L153-V202 HydrophobicContact CD2-CG1 3.74Å; L153-V202 HydrophobicContact CG-CG1 4.29Å; I198-V202 HydrophobicContact CG2-CG2 4.43Å; I198-V202 WeakPolarHBondContact O-CB 3.32Å; I198-V202 WeakPolarHBondContact O-CG2 3.42Å; I198-V202 PolarHBondContact O-N 3.48Å; V202-L204 PolarHBondContact O-N 3.02Å |
| 203 | K | 80.5 | Confident | 83.2 | Confident | 113 Ų | 113 | 54.3 Ų | 54.3 | 49% | 0.491 | 28% | 0.277 | S | S | . | . | trans | -70.5 | 51.8 | 179.4 | -58.3 | 179.7 | -174 | 174.8 | 0 | 113 | E149 E205 D206 A207 | E149-K203 IonicContact OE1-NZ 3.08Å; E149-K203 PolarHBondContact OE1-NZ 2.81Å; K203-E205 VanDerWaalsContact C-N 3.31Å; K203-D206 HydrophobicContact CB-CB 4.23Å; K203-D206 WeakPolarHBondContact CD-OD2 3.42Å; K203-A207 PolarHBondContact O-N 3.31Å | ||
| 204 | L | 83.8 | Confident | 83.1 | Confident | 2 Ų | 2 | 62.8 Ų | 62.8 | 1% | 0.01 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.9 | -37.8 | -179.9 | -178.1 | 56.6 | 0 | 0 | 0 | 110.8 | L154 L157 V199 V202 A207 L208 M222 L223 L245 | L154-L204 HydrophobicContact CD2-CD1 3.45Å; L154-L204 VanDerWaalsContact CD2-CD1 3.45Å; L157-L204 HydrophobicContact CD2-CD1 3.58Å; L157-L204 HydrophobicContact CD2-CD2 3.97Å; L157-L204 HydrophobicContact CD2-CG 4.34Å; V199-L204 HydrophobicContact CG1-CD2 3.97Å; V202-L204 PolarHBondContact O-N 3.02Å; L204-A207 WeakPolarHBondContact O-CB 3.37Å; L204-A207 PolarHBondContact O-N 3.33Å; L204-A207 VanDerWaalsContact O-N 3.15Å; L204-L208 HydrophobicContact CD1-CD1 4.2Å; L204-L208 HydrophobicContact CD1-CD2 4.45Å; L204-L208 HydrophobicContact CD1-CG 4.02Å; L204-L208 HydrophobicContact CG-CD1 3.94Å; L204-L208 HydrophobicContact CG-CG 4.22Å; L204-L208 WeakPolarHBondContact O-CG 3.49Å; L204-L208 PolarHBondContact O-N 2.85Å; L204-M222 HydrophobicContact CD2-CE 4.34Å; L204-L223 HydrophobicContact CD2-CD2 4.3Å; L204-L245 HydrophobicContact CB-CD2 4.39Å; L204-L245 HydrophobicContact CD2-CD1 4.33Å; L204-L245 HydrophobicContact CD2-CD2 4.46Å; L204-L245 HydrophobicContact CG-CD2 4.19Å |
| 205 | E | 85.4 | Confident | 83 | Confident | 88 Ų | 88 | 64.7 Ų | 64.7 | 41% | 0.411 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -58.3 | -51.6 | 176.8 | -175 | 154.8 | -147.4 | 0 | 0 | 112.3 | K203 A207 L208 S209 L245 K248 | K203-E205 VanDerWaalsContact C-N 3.31Å; E205-A207 PolarHBondContact O-N 2.92Å; E205-L208 PolarHBondContact O-N 3.18Å; E205-L208 VanDerWaalsContact O-N 3.14Å; E205-S209 WeakPolarHBondContact O-CB 3.49Å; E205-S209 PolarHBondContact O-N 3.49Å; E205-L245 HydrophobicContact CB-CD2 3.9Å; E205-K248 IonicContact OE1-NZ 2.83Å; E205-K248 PolarHBondContact OE1-NZ 3.38Å |
| 206 | D | 85.8 | Confident | 83.1 | Confident | 100 Ų | 100 | 65.5 Ų | 65.5 | 54% | 0.535 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -60.1 | -27.1 | 176.2 | -60 | -24.4 | 0 | 0 | 0 | 113.4 | K203 | K203-D206 HydrophobicContact CB-CB 4.23Å; K203-D206 WeakPolarHBondContact CD-OD2 3.42Å |
| 207 | A | 84.7 | Confident | 83.3 | Confident | 2 Ų | 2 | 68.1 Ų | 68.1 | 2% | 0.017 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -81.2 | -35.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L153 L154 K203 L204 E205 A213 | L153-A207 HydrophobicContact CD2-CB 4.01Å; L154-A207 HydrophobicContact CD2-CB 3.98Å; L154-A207 HydrophobicContact CG-CB 4.22Å; K203-A207 PolarHBondContact O-N 3.31Å; L204-A207 WeakPolarHBondContact O-CB 3.37Å; L204-A207 PolarHBondContact O-N 3.33Å; L204-A207 VanDerWaalsContact O-N 3.15Å; E205-A207 PolarHBondContact O-N 2.92Å; A207-A213 VanDerWaalsContact O-CB 3.26Å; A207-A213 WeakPolarHBondContact O-CB 3.38Å |
| 208 | L | 85.7 | Confident | 83.6 | Confident | 15 Ų | 15 | 67.7 Ų | 67.7 | 8% | 0.079 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -76.9 | -41.8 | 177.4 | -68.4 | 177.3 | 0 | 0 | 0 | 112.4 | L154 L204 E205 R210 V215 L245 K248 V249 | L154-L208 HydrophobicContact CD1-CD2 4.34Å; L154-L208 HydrophobicContact CD2-CD2 3.83Å; L154-L208 HydrophobicContact CD2-CG 4.34Å; L204-L208 HydrophobicContact CD1-CD1 4.2Å; L204-L208 HydrophobicContact CD1-CD2 4.45Å; L204-L208 HydrophobicContact CD1-CG 4.02Å; L204-L208 HydrophobicContact CG-CD1 3.94Å; L204-L208 HydrophobicContact CG-CG 4.22Å; L204-L208 WeakPolarHBondContact O-CG 3.49Å; L204-L208 PolarHBondContact O-N 2.85Å; E205-L208 PolarHBondContact O-N 3.18Å; E205-L208 VanDerWaalsContact O-N 3.14Å; L208-R210 PolarHBondContact O-N 2.9Å; L208-V215 HydrophobicContact CD2-CG1 4.16Å; L208-V215 HydrophobicContact CD2-CG2 3.58Å; L208-L245 HydrophobicContact CD1-CD2 3.92Å; L208-K248 HydrophobicContact CB-CB 4.32Å; L208-K248 HydrophobicContact CD1-CB 4.4Å; L208-V249 HydrophobicContact CD1-CG2 3.82Å; L208-V249 HydrophobicContact CD2-CG2 3.78Å; L208-V249 HydrophobicContact CG-CG2 4.43Å |
| 209 | S | 85.5 | Confident | 84 | Confident | 61 Ų | 61 | 67.6 Ų | 67.6 | 43% | 0.427 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -68.7 | 7.4 | 178.3 | -78.9 | 0 | 0 | 0 | 0 | 114.6 | E205 K248 | E205-S209 WeakPolarHBondContact O-CB 3.49Å; E205-S209 PolarHBondContact O-N 3.49Å; S209-K248 WeakPolarHBondContact OG-CE 3.33Å; S209-K248 PolarHBondContact OG-NZ 3.27Å |
| 210 | R | 85.8 | Confident | 84.5 | Confident | 138 Ų | 138 | 69.2 Ų | 69.2 | 52% | 0.521 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -86.2 | 126.9 | 179.1 | -170.7 | 174.3 | -62.7 | -124.4 | -1.7 | 110.2 | L208 R212 A213 | L208-R210 PolarHBondContact O-N 2.9Å; R210-R212 PolarHBondContact O-N 2.83Å; R210-A213 HydrophobicContact CB-CB 4.32Å; R210-A213 VanDerWaalsContact O-CB 3.26Å; R210-A213 WeakPolarHBondContact O-CB 3.37Å; R210-A213 PolarHBondContact O-N 3.14Å |
| 211 | P | 70.5 | Confident | 85.2 | Confident | 133 Ų | 133 | 72.1 Ų | 72.1 | 86% | 0.864 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | 2.1 | -175.8 | -26.9 | 34.8 | 0 | 0 | 0 | 117.7 | ||
| 212 | R | 72.7 | Confident | 86.2 | Confident | 233 Ų | 233 | 69.1 Ų | 69.1 | 88% | 0.879 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -130.6 | 15.4 | 175.6 | -61.2 | -175 | -177.7 | 176.8 | 1 | 112.3 | R210 R214 | R210-R212 PolarHBondContact O-N 2.83Å; R212-R214 PolarHBondContact O-N 2.89Å |
| 213 | A | 81.8 | Confident | 86.7 | Confident | 30 Ų | 30 | 68.1 Ų | 68.1 | 25% | 0.248 | 34% | 0.337 | C | S | . | . | trans | -67 | 120.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | L154 A207 R210 | L154-A213 HydrophobicContact CD1-CB 4.04Å; A207-A213 VanDerWaalsContact O-CB 3.26Å; A207-A213 WeakPolarHBondContact O-CB 3.38Å; R210-A213 HydrophobicContact CB-CB 4.32Å; R210-A213 VanDerWaalsContact O-CB 3.26Å; R210-A213 WeakPolarHBondContact O-CB 3.37Å; R210-A213 PolarHBondContact O-N 3.14Å | ||
| 214 | R | 88.1 | Confident | 87.2 | Confident | 204 Ų | 204 | 66.4 Ų | 66.4 | 77% | 0.77 | 33% | 0.334 | S | S | * | . | trans | -100.7 | 101.8 | 169.2 | -178.2 | 178.3 | -179.8 | 161 | 1.2 | 107.5 | Q151 R212 P216 | Q151-R214 PolarHBondContact NE2-O 3.46Å; Q151-R214 PolarHBondContact OE1-O 3.31Å; R212-R214 PolarHBondContact O-N 2.89Å; R214-P216 VanDerWaalsContact O-CD 3.29Å; R214-P216 WeakPolarHBondContact O-CD 3.23Å | ||
| 215 | V | 89.1 | Confident | 87.6 | Confident | 40 Ų | 40 | 68.6 Ų | 68.6 | 24% | 0.242 | 34% | 0.344 | C | S | . | . | trans | -69.4 | 123.4 | -179.8 | -166.8 | 0 | 0 | 0 | 0 | 109.6 | L208 V219 V249 | L208-V215 HydrophobicContact CD2-CG1 4.16Å; L208-V215 HydrophobicContact CD2-CG2 3.58Å; V215-V219 HydrophobicContact CG1-CB 3.88Å; V215-V219 HydrophobicContact CG1-CG1 3.85Å; V215-V249 HydrophobicContact CB-CG1 4.28Å; V215-V249 HydrophobicContact CG1-CG1 3.73Å; V215-V249 HydrophobicContact CG1-CG2 4.05Å; V215-V249 HydrophobicContact CG2-CG1 4.49Å; V215-V249 HydrophobicContact CG2-CG2 4.21Å | ||
| 216 | P | 92.4 | Very high | 87.8 | Confident | 19 Ų | 19 | 64.4 Ų | 64.4 | 12% | 0.123 | 33% | 0.325 | C | S | . | . | trans | -67.2 | 146.9 | 173.7 | -21.5 | 34.5 | 0 | 0 | 0 | 111.2 | L154 A158 R214 S218 V219 T220 | L154-P216 HydrophobicContact CB-CG 4.3Å; A158-P216 HydrophobicContact CB-CB 3.79Å; A158-P216 HydrophobicContact CB-CG 4.04Å; R214-P216 VanDerWaalsContact O-CD 3.29Å; R214-P216 WeakPolarHBondContact O-CD 3.23Å; P216-S218 PolarHBondContact O-N 3.06Å; P216-V219 HydrophobicContact CB-CG2 4.28Å; P216-V219 HydrophobicContact CG-CG2 4.22Å; P216-V219 WeakPolarHBondContact O-CB 3.32Å; P216-V219 PolarHBondContact O-N 3.22Å; P216-T220 PolarHBondContact O-N 3.49Å | ||
| 217 | P | 92.4 | Very high | 87.9 | Confident | 106 Ų | 106 | 61.7 Ų | 61.7 | 69% | 0.688 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -60 | -33.7 | -178.7 | 24.7 | -34.2 | 0 | 0 | 0 | 112.6 | V219 T220 Q221 | P217-V219 VanDerWaalsContact C-N 3.27Å; P217-V219 PolarHBondContact O-N 3.39Å; P217-T220 WeakPolarHBondContact O-CB 3.09Å; P217-T220 PolarHBondContact O-N 3.09Å; P217-Q221 WeakPolarHBondContact O-CB 3.25Å; P217-Q221 PolarHBondContact O-N 3.32Å |
| 218 | S | 93.4 | Very high | 87.9 | Confident | 20 Ų | 20 | 64 Ų | 64 | 14% | 0.14 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.2 | -35.5 | 173.9 | -46.1 | 0 | 0 | 0 | 0 | 112.7 | D162 P216 M222 | D162-S218 VanDerWaalsContact OD1-CB 3.26Å; D162-S218 WeakPolarHBondContact OD1-CB 3.37Å; D162-S218 PolarHBondContact OD1-OG 3.28Å; D162-S218 WeakPolarHBondContact OD2-CB 3.47Å; D162-S218 PolarHBondContact OD2-OG 3.06Å; P216-S218 PolarHBondContact O-N 3.06Å; S218-M222 VanDerWaalsContact O-CB 3.22Å; S218-M222 WeakPolarHBondContact O-CB 3.22Å; S218-M222 PolarHBondContact O-N 3.2Å |
| 219 | V | 91.9 | Very high | 87.8 | Confident | 0 Ų | 0 | 63.5 Ų | 63.5 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -72.7 | -38.3 | 177 | 177.9 | 0 | 0 | 0 | 0 | 110.7 | L157 A158 V215 P216 P217 M222 L223 | L157-V219 HydrophobicContact CD2-CG1 4.48Å; L157-V219 HydrophobicContact CG-CG2 4.37Å; A158-V219 HydrophobicContact CB-CG2 4Å; V215-V219 HydrophobicContact CG1-CB 3.88Å; V215-V219 HydrophobicContact CG1-CG1 3.85Å; P216-V219 HydrophobicContact CB-CG2 4.28Å; P216-V219 HydrophobicContact CG-CG2 4.22Å; P216-V219 WeakPolarHBondContact O-CB 3.32Å; P216-V219 PolarHBondContact O-N 3.22Å; P217-V219 VanDerWaalsContact C-N 3.27Å; P217-V219 PolarHBondContact O-N 3.39Å; V219-M222 HydrophobicContact CG1-CE 3.96Å; V219-M222 WeakPolarHBondContact O-CB 3.17Å; V219-M222 PolarHBondContact O-N 3.48Å; V219-L223 HydrophobicContact CG1-CD1 4.32Å; V219-L223 WeakPolarHBondContact O-CG 3.37Å; V219-L223 PolarHBondContact O-N 2.82Å |
| 220 | T | 91.5 | Very high | 87.4 | Confident | 36 Ų | 36 | 65.4 Ų | 65.4 | 22% | 0.221 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61.9 | -48.3 | 172 | -49.8 | 0 | 0 | 0 | 0 | 111.3 | P216 P217 M222 L223 L224 V249 V250 | P216-T220 PolarHBondContact O-N 3.49Å; P217-T220 WeakPolarHBondContact O-CB 3.09Å; P217-T220 PolarHBondContact O-N 3.09Å; T220-M222 PolarHBondContact O-N 3.44Å; T220-L223 PolarHBondContact O-N 3.45Å; T220-L224 HydrophobicContact CG2-CD1 4.1Å; T220-L224 WeakPolarHBondContact O-CG 3.43Å; T220-L224 PolarHBondContact O-N 3.32Å; T220-L224 VanDerWaalsContact O-N 3.1Å; T220-V249 HydrophobicContact CG2-CG1 3.72Å; T220-V249 WeakPolarHBondContact OG1-CG1 3.26Å; T220-V250 HydrophobicContact CG2-CG2 3.96Å |
| 221 | Q | 94 | Very high | 86.9 | Confident | 89 Ų | 89 | 61.1 Ų | 61.1 | 42% | 0.416 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.1 | -43.9 | 176.6 | -177.7 | -170.4 | -13.3 | 0 | 0 | 111.6 | P217 L224 I225 | P217-Q221 WeakPolarHBondContact O-CB 3.25Å; P217-Q221 PolarHBondContact O-N 3.32Å; Q221-L224 PolarHBondContact O-N 3.02Å; Q221-I225 HydrophobicContact CG-CD1 3.74Å; Q221-I225 HydrophobicContact CG-CG1 4.48Å; Q221-I225 WeakPolarHBondContact O-CB 3.37Å; Q221-I225 VanDerWaalsContact O-CG1 3.28Å; Q221-I225 WeakPolarHBondContact O-CG1 3.33Å; Q221-I225 PolarHBondContact O-N 2.86Å |
| 222 | M | 94.3 | Very high | 86.6 | Confident | 0 Ų | 0 | 61.1 Ų | 61.1 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -55.4 | -54.5 | 175.2 | 174.6 | -169.4 | 78.3 | 0 | 0 | 111.6 | L157 W161 F194 V199 L204 S218 V219 T220 L224 I225 L226 | L157-M222 HydrophobicContact CD1-SD 4.1Å; L157-M222 HydrophobicContact CD2-CE 4.02Å; L157-M222 HydrophobicContact CG-CE 4.32Å; L157-M222 HydrophobicContact CG-SD 4.25Å; W161-M222 HydrophobicContact CB-CG 4.49Å; W161-M222 HydrophobicContact CB-SD 4.06Å; W161-M222 HydrophobicContact CD2-CB 3.53Å; W161-M222 HydrophobicContact CD2-CG 3.5Å; W161-M222 VanDerWaalsContact CD2-CG 3.5Å; W161-M222 HydrophobicContact CD2-SD 4.17Å; W161-M222 HydrophobicContact CE3-CB 4.07Å; W161-M222 HydrophobicContact CE3-CG 3.49Å; W161-M222 VanDerWaalsContact CE3-CG 3.49Å; W161-M222 HydrophobicContact CE3-SD 4.1Å; W161-M222 HydrophobicContact CG-CB 3.72Å; W161-M222 HydrophobicContact CG-CG 3.95Å; W161-M222 HydrophobicContact CG-SD 4.16Å; W161-M222 HydrophobicContact CH2-CG 4.24Å; W161-M222 HydrophobicContact CZ2-CB 4.09Å; W161-M222 HydrophobicContact CZ2-CG 4.31Å; W161-M222 HydrophobicContact CZ3-CG 3.86Å; F194-M222 HydrophobicContact CE1-CG 4.19Å; F194-M222 HydrophobicContact CE1-SD 3.55Å; F194-M222 VanDerWaalsContact CE1-SD 3.55Å; F194-M222 HydrophobicContact CZ-SD 4.03Å; V199-M222 HydrophobicContact CG2-CE 3.99Å; V199-M222 HydrophobicContact CG2-SD 4.17Å; L204-M222 HydrophobicContact CD2-CE 4.34Å; S218-M222 VanDerWaalsContact O-CB 3.22Å; S218-M222 WeakPolarHBondContact O-CB 3.22Å; S218-M222 PolarHBondContact O-N 3.2Å; V219-M222 HydrophobicContact CG1-CE 3.96Å; V219-M222 WeakPolarHBondContact O-CB 3.17Å; V219-M222 PolarHBondContact O-N 3.48Å; T220-M222 PolarHBondContact O-N 3.44Å; M222-L224 VanDerWaalsContact C-N 3.34Å; M222-L224 PolarHBondContact O-N 2.97Å; M222-I225 PolarHBondContact O-N 3.25Å; M222-L226 HydrophobicContact CG-CD1 3.76Å; M222-L226 HydrophobicContact CG-CG 4.4Å; M222-L226 WeakPolarHBondContact O-CB 3.44Å; M222-L226 VanDerWaalsContact O-CG 3.25Å; M222-L226 WeakPolarHBondContact O-CG 3.24Å; M222-L226 PolarHBondContact O-N 2.84Å |
| 223 | L | 91.1 | Very high | 86.1 | Confident | 1 Ų | 1 | 60.9 Ų | 60.9 | 1% | 0.005 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.8 | -43.6 | -177.2 | -70.9 | 171.8 | 0 | 0 | 0 | 111.5 | V199 L204 V219 T220 I225 L226 Q227 L242 L245 V246 V249 | V199-L223 HydrophobicContact CG1-CD2 3.99Å; L204-L223 HydrophobicContact CD2-CD2 4.3Å; V219-L223 HydrophobicContact CG1-CD1 4.32Å; V219-L223 WeakPolarHBondContact O-CG 3.37Å; V219-L223 PolarHBondContact O-N 2.82Å; T220-L223 PolarHBondContact O-N 3.45Å; L223-I225 PolarHBondContact O-N 3.38Å; L223-L226 PolarHBondContact O-N 3Å; L223-Q227 PolarHBondContact O-N 3.34Å; L223-L242 HydrophobicContact CD2-CD1 3.7Å; L223-L245 HydrophobicContact CD2-CB 4.19Å; L223-V246 HydrophobicContact CB-CG2 4Å; L223-V249 HydrophobicContact CD1-CB 4.25Å; L223-V249 HydrophobicContact CD1-CG2 3.69Å |
| 224 | L | 91.2 | Very high | 85.3 | Confident | 78 Ų | 78 | 61.9 Ų | 61.9 | 41% | 0.408 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.6 | -39 | 175.8 | -71.2 | 170.7 | 0 | 0 | 0 | 113.1 | T220 Q221 M222 V246 V250 | T220-L224 HydrophobicContact CG2-CD1 4.1Å; T220-L224 WeakPolarHBondContact O-CG 3.43Å; T220-L224 PolarHBondContact O-N 3.32Å; T220-L224 VanDerWaalsContact O-N 3.1Å; Q221-L224 PolarHBondContact O-N 3.02Å; M222-L224 VanDerWaalsContact C-N 3.34Å; M222-L224 PolarHBondContact O-N 2.97Å; L224-V246 HydrophobicContact CD2-CG1 4.19Å; L224-V250 HydrophobicContact CD1-CG2 4.42Å; L224-V250 HydrophobicContact CD2-CG2 4.23Å; L224-V250 HydrophobicContact CG-CG2 4.4Å |
| 225 | I | 91.8 | Very high | 84.3 | Confident | 47 Ų | 47 | 57 Ų | 57 | 24% | 0.241 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -68.4 | -40.6 | 176 | -73.9 | 172.2 | 0 | 0 | 0 | 111 | W161 F165 L191 Q221 M222 L223 Q227 G228 V229 | W161-I225 HydrophobicContact CH2-CB 4.47Å; W161-I225 HydrophobicContact CH2-CG2 4.06Å; W161-I225 HydrophobicContact CZ2-CB 4.35Å; W161-I225 HydrophobicContact CZ2-CD1 4.06Å; W161-I225 HydrophobicContact CZ2-CG2 4.27Å; F165-I225 HydrophobicContact CE1-CD1 4.44Å; F165-I225 HydrophobicContact CE2-CD1 3.85Å; F165-I225 HydrophobicContact CE2-CG2 4.09Å; F165-I225 HydrophobicContact CZ-CD1 3.71Å; L191-I225 HydrophobicContact CD1-CG2 4.41Å; L191-I225 HydrophobicContact CD2-CG2 4.15Å; Q221-I225 HydrophobicContact CG-CD1 3.74Å; Q221-I225 HydrophobicContact CG-CG1 4.48Å; Q221-I225 WeakPolarHBondContact O-CB 3.37Å; Q221-I225 VanDerWaalsContact O-CG1 3.28Å; Q221-I225 WeakPolarHBondContact O-CG1 3.33Å; Q221-I225 PolarHBondContact O-N 2.86Å; M222-I225 PolarHBondContact O-N 3.25Å; L223-I225 PolarHBondContact O-N 3.38Å; I225-Q227 VanDerWaalsContact C-N 3.32Å; I225-G228 PolarHBondContact O-N 3.39Å; I225-V229 WeakPolarHBondContact O-CG2 3.36Å |
| 226 | L | 90.6 | Very high | 83.7 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -72.4 | -24.5 | 179.6 | -65.6 | 176 | 0 | 0 | 0 | 112.8 | W161 L191 F194 R195 V199 M222 L223 G228 V229 L242 | W161-L226 HydrophobicContact CZ3-CD2 4.4Å; L191-L226 HydrophobicContact CB-CD2 4Å; L191-L226 HydrophobicContact CD2-CD2 4.01Å; L191-L226 WeakPolarHBondContact O-CD2 3.38Å; F194-L226 HydrophobicContact CD1-CD1 3.93Å; F194-L226 HydrophobicContact CE1-CD1 4.37Å; R195-L226 HydrophobicContact CB-CD1 4.34Å; R195-L226 HydrophobicContact CB-CD2 4.32Å; V199-L226 HydrophobicContact CG2-CD1 3.63Å; M222-L226 HydrophobicContact CG-CD1 3.76Å; M222-L226 HydrophobicContact CG-CG 4.4Å; M222-L226 WeakPolarHBondContact O-CB 3.44Å; M222-L226 VanDerWaalsContact O-CG 3.25Å; M222-L226 WeakPolarHBondContact O-CG 3.24Å; M222-L226 PolarHBondContact O-N 2.84Å; L223-L226 PolarHBondContact O-N 3Å; L226-G228 VanDerWaalsContact C-N 3.32Å; L226-G228 PolarHBondContact O-N 3.23Å; L226-V229 WeakPolarHBondContact O-CB 3.36Å; L226-V229 PolarHBondContact O-N 2.91Å; L226-V229 VanDerWaalsContact O-N 3.1Å; L226-L242 HydrophobicContact CB-CD2 3.95Å; L226-L242 WeakPolarHBondContact O-CD2 3.38Å |
| 227 | Q | 86.9 | Confident | 83.1 | Confident | 43 Ų | 43 | 63.8 Ų | 63.8 | 20% | 0.201 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -59.6 | -42.1 | 174 | -171.9 | -165.6 | -12.3 | 0 | 0 | 111.4 | L223 I225 V229 H230 Y239 Y253 | L223-Q227 PolarHBondContact O-N 3.34Å; I225-Q227 VanDerWaalsContact C-N 3.32Å; Q227-V229 PolarHBondContact O-N 3.4Å; Q227-V229 VanDerWaalsContact O-N 3.17Å; Q227-H230 PolarHBondContact O-CE1 3.18Å; Q227-Y239 WeakPolarHBondContact O-CE2 3.47Å; Q227-Y253 VanDerWaalsContact CD-OH 3.24Å; Q227-Y253 PolarHBondContact NE2-OH 3.44Å |
| 228 | G | 84.3 | Confident | 82.6 | Confident | 51 Ų | 51 | 60.8 Ų | 60.8 | 53% | 0.526 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | 0.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | I225 L226 | I225-G228 PolarHBondContact O-N 3.39Å; L226-G228 VanDerWaalsContact C-N 3.32Å; L226-G228 PolarHBondContact O-N 3.23Å |
| 229 | V | 83.9 | Confident | 82.1 | Confident | 4 Ų | 4 | 60.7 Ų | 60.7 | 2% | 0.024 | 33% | 0.331 | C | S | . | . | trans | -102.5 | 84.1 | -174.8 | 177.8 | 0 | 0 | 0 | 0 | 109.6 | Q188 L191 L192 R195 I225 L226 Q227 | Q188-V229 HydrophobicContact CG-CG1 4.46Å; L191-V229 HydrophobicContact CB-CB 4.5Å; L191-V229 HydrophobicContact CB-CG1 3.95Å; L191-V229 HydrophobicContact CB-CG2 3.89Å; L191-V229 HydrophobicContact CD1-CG2 3.87Å; L191-V229 HydrophobicContact CG-CG2 4.47Å; L192-V229 HydrophobicContact CB-CG1 4.08Å; L192-V229 HydrophobicContact CD1-CG1 4.16Å; R195-V229 PolarHBondContact NH1-O 2.9Å; I225-V229 WeakPolarHBondContact O-CG2 3.36Å; L226-V229 WeakPolarHBondContact O-CB 3.36Å; L226-V229 PolarHBondContact O-N 2.91Å; L226-V229 VanDerWaalsContact O-N 3.1Å; Q227-V229 PolarHBondContact O-N 3.4Å; Q227-V229 VanDerWaalsContact O-N 3.17Å | ||
| 230 | H | 77 | Confident | 81.8 | Confident | 101 Ų | 101 | 62.7 Ų | 62.7 | 47% | 0.468 | 34% | 0.341 | S | S | . | . | trans | -87.4 | 155.7 | 178.2 | -51.4 | -70.2 | 0 | 0 | 0 | 113.1 | Q188 Q227 Y239 | Q188-H230 PolarHBondContact NE2-O 3Å; Q227-H230 PolarHBondContact O-CE1 3.18Å; H230-Y239 AromaticContact CE1-CE2 3.4Å; H230-Y239 WeakPolarHBondContact CE1-CE2 3.24Å; H230-Y239 AromaticContact CE1-CZ 3.76Å; H230-Y239 AromaticContact ND1-CD2 3.83Å; H230-Y239 AromaticContact ND1-CE2 3.44Å; H230-Y239 WeakPolarHBondContact ND1-CE2 3.32Å | ||
| 231 | E | 75.5 | Confident | 81.5 | Confident | 48 Ų | 48 | 66.5 Ų | 66.5 | 22% | 0.224 | 35% | 0.352 | C | S | . | . | trans | -92.1 | 149.9 | 167.4 | -61.7 | -176 | -163.6 | 0 | 0 | 109.6 | L192 R195 N196 R233 G234 | L192-E231 HydrophobicContact CD1-CG 3.41Å; L192-E231 VanDerWaalsContact CD1-CG 3.41Å; L192-E231 HydrophobicContact CD2-CG 3.77Å; L192-E231 HydrophobicContact CG-CG 4.17Å; R195-E231 IonicContact CZ-OE1 2.81Å; R195-E231 IonicContact NH2-OE1 3.83Å; R195-E231 PolarHBondContact NH2-OE1 3.32Å; N196-E231 PolarHBondContact ND2-OE1 2.99Å; N196-E231 VanDerWaalsContact ND2-OE1 3.09Å; E231-R233 PolarHBondContact O-N 3.33Å; E231-G234 PolarHBondContact O-N 3.4Å | ||
| 232 | S | 65.2 | Low | 81.1 | Confident | 133 Ų | 133 | 62.2 Ų | 62.2 | 93% | 0.93 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | 4.3 | 178.3 | 51.8 | 0 | 0 | 0 | 0 | 114.9 | ||
| 233 | R | 62.8 | Low | 80.8 | Confident | 229 Ų | 229 | 62.4 Ų | 62.4 | 86% | 0.864 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.6 | 11.9 | 178.2 | -82.7 | -170.8 | -86.6 | -156.1 | -5.3 | 114.6 | E231 | E231-R233 PolarHBondContact O-N 3.33Š|
| 234 | G | 63.5 | Low | 80.6 | Confident | 50 Ų | 50 | 63.8 Ų | 63.8 | 52% | 0.515 | 34% | 0.342 | S | S | . | . | trans | 85 | -160.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | E231 N236 | E231-G234 PolarHBondContact O-N 3.4Å; G234-N236 PolarHBondContact O-N 2.96Å | ||
| 235 | V | 68 | Low | 80.4 | Confident | 101 Ų | 101 | 60.4 Ų | 60.4 | 61% | 0.612 | 33% | 0.325 | S | S | * | . | S | Bend | trans | -70 | 118.2 | -179.6 | -176.6 | 0 | 0 | 0 | 0 | 109.2 | Y239 L240 | V235-Y239 HydrophobicContact CG1-CD1 4.2Å; V235-L240 HydrophobicContact CG1-CD2 3.82Å; V235-L240 HydrophobicContact CG1-CG 4.12Å |
| 236 | N | 76.4 | Confident | 80.3 | Confident | 68 Ų | 68 | 58.2 Ų | 58.2 | 36% | 0.364 | 31% | 0.313 | S | S | . | . | trans | -113.6 | 155.8 | 179.8 | -170.8 | 3.5 | 0 | 0 | 0 | 109.2 | G234 D238 Y239 L240 | G234-N236 PolarHBondContact O-N 2.96Å; N236-D238 PolarHBondContact O-N 2.95Å; N236-Y239 WeakPolarHBondContact O-CA 3.24Å; N236-Y239 VanDerWaalsContact O-CB 3.32Å; N236-Y239 WeakPolarHBondContact O-CB 3.48Å; N236-Y239 PolarHBondContact O-N 2.92Å; N236-L240 PolarHBondContact O-N 2.94Å; N236-L240 VanDerWaalsContact O-N 3.15Å | ||
| 237 | E | 79.7 | Confident | 80.2 | Confident | 135 Ų | 135 | 60.7 Ų | 60.7 | 63% | 0.631 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -52.8 | -38.1 | 174 | -67.3 | -63.4 | 145.5 | 0 | 0 | 111.6 | Y239 L240 R241 | E237-Y239 PolarHBondContact O-N 3.38Å; E237-L240 PolarHBondContact O-N 3.38Å; E237-R241 WeakPolarHBondContact O-CG 3.39Å; E237-R241 PolarHBondContact O-N 3.38Å |
| 238 | D | 81.7 | Confident | 80.1 | Confident | 42 Ų | 42 | 61.9 Ų | 61.9 | 23% | 0.225 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -60.1 | -30.4 | 174.5 | -73.2 | 3 | 0 | 0 | 0 | 113.7 | L200 N236 R241 L242 | L200-D238 HydrophobicContact CD1-CB 3.6Å; L200-D238 WeakPolarHBondContact CD1-O 3.43Å; N236-D238 PolarHBondContact O-N 2.95Å; D238-R241 IonicContact OD1-CZ 2.74Å; D238-R241 IonicContact OD1-NE 2.67Å; D238-R241 IonicContact OD1-NH2 3.61Å; D238-R241 PolarHBondContact OD1-NH2 3.46Å; D238-L242 PolarHBondContact O-N 3.23Å |
| 239 | Y | 83.3 | Confident | 80.2 | Confident | 18 Ų | 18 | 60.9 Ų | 60.9 | 7% | 0.071 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -78.9 | -42.1 | 175.2 | 176.7 | -91.2 | 0 | 0 | 0 | 111 | Q227 H230 V235 N236 E237 R241 L242 E243 T256 | Q227-Y239 WeakPolarHBondContact O-CE2 3.47Å; H230-Y239 AromaticContact CE1-CE2 3.4Å; H230-Y239 WeakPolarHBondContact CE1-CE2 3.24Å; H230-Y239 AromaticContact CE1-CZ 3.76Å; H230-Y239 AromaticContact ND1-CD2 3.83Å; H230-Y239 AromaticContact ND1-CE2 3.44Å; H230-Y239 WeakPolarHBondContact ND1-CE2 3.32Å; V235-Y239 HydrophobicContact CG1-CD1 4.2Å; N236-Y239 WeakPolarHBondContact O-CA 3.24Å; N236-Y239 VanDerWaalsContact O-CB 3.32Å; N236-Y239 WeakPolarHBondContact O-CB 3.48Å; N236-Y239 PolarHBondContact O-N 2.92Å; E237-Y239 PolarHBondContact O-N 3.38Å; Y239-R241 VanDerWaalsContact C-N 3.29Å; Y239-R241 PolarHBondContact O-N 3.06Å; Y239-L242 WeakPolarHBondContact O-CA 3.37Å; Y239-L242 WeakPolarHBondContact O-CB 3.31Å; Y239-L242 PolarHBondContact O-N 3.38Å; Y239-E243 HydrophobicContact CD1-CG 4.11Å; Y239-E243 HydrophobicContact CE1-CG 3.52Å; Y239-E243 WeakPolarHBondContact CE1-OE1 3.37Å; Y239-E243 PolarHBondContact O-N 3.08Å; Y239-E243 PolarHBondContact OH-OE1 2.75Å; Y239-T256 HydrophobicContact CE1-CG2 3.88Å |
| 240 | L | 84.8 | Confident | 80.3 | Confident | 42 Ų | 42 | 62.5 Ų | 62.5 | 22% | 0.22 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.5 | -38.4 | 174.7 | -60 | -179.1 | 0 | 0 | 0 | 111.9 | V235 N236 E237 L242 E243 S244 T256 | V235-L240 HydrophobicContact CG1-CD2 3.82Å; V235-L240 HydrophobicContact CG1-CG 4.12Å; N236-L240 PolarHBondContact O-N 2.94Å; N236-L240 VanDerWaalsContact O-N 3.15Å; E237-L240 PolarHBondContact O-N 3.38Å; L240-L242 VanDerWaalsContact C-N 3.26Å; L240-L242 PolarHBondContact O-N 3.07Å; L240-E243 PolarHBondContact O-N 3.1Å; L240-E243 VanDerWaalsContact O-N 3.15Å; L240-S244 PolarHBondContact O-N 3.48Å; L240-T256 VanDerWaalsContact CD2-OG1 3.28Å; L240-T256 WeakPolarHBondContact CD2-OG1 3.38Å |
| 241 | R | 84.8 | Confident | 80.5 | Confident | 116 Ų | 116 | 62 Ų | 62 | 44% | 0.438 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -65.6 | -23.8 | 170.8 | -69.5 | -168 | -64.2 | 145.4 | -6.6 | 113.7 | L200 E237 D238 Y239 S244 L245 | L200-R241 HydrophobicContact CD2-CB 3.89Å; E237-R241 WeakPolarHBondContact O-CG 3.39Å; E237-R241 PolarHBondContact O-N 3.38Å; D238-R241 IonicContact OD1-CZ 2.74Å; D238-R241 IonicContact OD1-NE 2.67Å; D238-R241 IonicContact OD1-NH2 3.61Å; D238-R241 PolarHBondContact OD1-NH2 3.46Å; Y239-R241 VanDerWaalsContact C-N 3.29Å; Y239-R241 PolarHBondContact O-N 3.06Å; R241-S244 PolarHBondContact O-OG 3.17Å; R241-L245 WeakPolarHBondContact O-CD1 3.29Å; R241-L245 WeakPolarHBondContact O-CG 3.41Å |
| 242 | L | 87.3 | Confident | 80.9 | Confident | 0 Ų | 0 | 64.5 Ų | 64.5 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -76.2 | -41.6 | 168.7 | -179 | 67.3 | 0 | 0 | 0 | 110.8 | R195 V199 L223 L226 D238 Y239 L240 S244 L245 V246 | R195-L242 HydrophobicContact CG-CD2 4.16Å; V199-L242 HydrophobicContact CG1-CD1 3.9Å; L223-L242 HydrophobicContact CD2-CD1 3.7Å; L226-L242 HydrophobicContact CB-CD2 3.95Å; L226-L242 WeakPolarHBondContact O-CD2 3.38Å; D238-L242 PolarHBondContact O-N 3.23Å; Y239-L242 WeakPolarHBondContact O-CA 3.37Å; Y239-L242 WeakPolarHBondContact O-CB 3.31Å; Y239-L242 PolarHBondContact O-N 3.38Å; L240-L242 VanDerWaalsContact C-N 3.26Å; L240-L242 PolarHBondContact O-N 3.07Å; L242-S244 VanDerWaalsContact C-N 3.34Å; L242-S244 PolarHBondContact O-N 3.28Å; L242-L245 WeakPolarHBondContact O-CB 3.49Å; L242-L245 PolarHBondContact O-N 2.98Å; L242-L245 VanDerWaalsContact O-N 3.11Å; L242-V246 HydrophobicContact CG-CG2 4.36Å; L242-V246 WeakPolarHBondContact O-CG2 3.47Å; L242-V246 PolarHBondContact O-N 3.31Å |
| 243 | E | 87.4 | Confident | 81.7 | Confident | 3 Ų | 3 | 58.6 Ų | 58.6 | 1% | 0.014 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.1 | -39.9 | 179.5 | -63.2 | -152 | 127.7 | 0 | 0 | 112.5 | Y239 L240 L245 V246 Q247 Y253 T256 | Y239-E243 HydrophobicContact CD1-CG 4.11Å; Y239-E243 HydrophobicContact CE1-CG 3.52Å; Y239-E243 WeakPolarHBondContact CE1-OE1 3.37Å; Y239-E243 PolarHBondContact O-N 3.08Å; Y239-E243 PolarHBondContact OH-OE1 2.75Å; L240-E243 PolarHBondContact O-N 3.1Å; L240-E243 VanDerWaalsContact O-N 3.15Å; E243-L245 VanDerWaalsContact C-N 3.29Å; E243-L245 PolarHBondContact O-N 3.23Å; E243-V246 PolarHBondContact O-N 3.12Å; E243-Q247 PolarHBondContact O-N 2.71Å; E243-Y253 HydrophobicContact CB-CE1 4.07Å; E243-Y253 WeakPolarHBondContact CG-OH 3.36Å; E243-Y253 PolarHBondContact OE1-OH 3.42Å; E243-T256 PolarHBondContact OE1-N 3.5Å; E243-T256 WeakPolarHBondContact OE2-CB 3.4Å; E243-T256 WeakPolarHBondContact OE2-CG2 3.42Å; E243-T256 PolarHBondContact OE2-N 3Å; E243-T256 PolarHBondContact OE2-OG1 2.89Å |
| 244 | S | 86.4 | Confident | 82.6 | Confident | 31 Ų | 31 | 53.3 Ų | 53.3 | 22% | 0.217 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64.1 | -31.9 | 174.8 | 67.2 | 0 | 0 | 0 | 0 | 113 | L240 R241 L242 K248 | L240-S244 PolarHBondContact O-N 3.48Å; R241-S244 PolarHBondContact O-OG 3.17Å; L242-S244 VanDerWaalsContact C-N 3.34Å; L242-S244 PolarHBondContact O-N 3.28Å; S244-K248 WeakPolarHBondContact O-CG 3.41Å; S244-K248 PolarHBondContact O-N 3.34Å |
| 245 | L | 87.7 | Confident | 83.5 | Confident | 7 Ų | 7 | 51.4 Ų | 51.4 | 4% | 0.037 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -71.8 | -38.8 | 172.7 | -67.2 | 167.8 | 0 | 0 | 0 | 111.8 | V199 L204 E205 L208 L223 R241 L242 E243 K248 | V199-L245 HydrophobicContact CG1-CD1 3.77Å; L204-L245 HydrophobicContact CB-CD2 4.39Å; L204-L245 HydrophobicContact CD2-CD1 4.33Å; L204-L245 HydrophobicContact CD2-CD2 4.46Å; L204-L245 HydrophobicContact CG-CD2 4.19Å; E205-L245 HydrophobicContact CB-CD2 3.9Å; L208-L245 HydrophobicContact CD1-CD2 3.92Å; L223-L245 HydrophobicContact CD2-CB 4.19Å; R241-L245 WeakPolarHBondContact O-CD1 3.29Å; R241-L245 WeakPolarHBondContact O-CG 3.41Å; L242-L245 WeakPolarHBondContact O-CB 3.49Å; L242-L245 PolarHBondContact O-N 2.98Å; L242-L245 VanDerWaalsContact O-N 3.11Å; E243-L245 VanDerWaalsContact C-N 3.29Å; E243-L245 PolarHBondContact O-N 3.23Å; L245-K248 PolarHBondContact O-N 3.07Å |
| 246 | V | 89.2 | Confident | 83.9 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65 | -44.5 | 176.7 | -178.3 | 0 | 0 | 0 | 0 | 110.4 | L223 L224 L242 E243 K248 V249 V250 Y253 | L223-V246 HydrophobicContact CB-CG2 4Å; L224-V246 HydrophobicContact CD2-CG1 4.19Å; L242-V246 HydrophobicContact CG-CG2 4.36Å; L242-V246 WeakPolarHBondContact O-CG2 3.47Å; L242-V246 PolarHBondContact O-N 3.31Å; E243-V246 PolarHBondContact O-N 3.12Å; V246-K248 VanDerWaalsContact C-N 3.26Å; V246-K248 PolarHBondContact O-N 3.47Å; V246-V249 PolarHBondContact O-N 2.96Å; V246-V250 HydrophobicContact CG1-CB 4.4Å; V246-V250 HydrophobicContact CG1-CG2 4.26Å; V246-V250 PolarHBondContact O-N 2.85Å; V246-Y253 HydrophobicContact CB-CD2 4.41Å; V246-Y253 HydrophobicContact CB-CE2 3.98Å; V246-Y253 HydrophobicContact CG1-CD2 3.58Å; V246-Y253 HydrophobicContact CG1-CE2 3.32Å; V246-Y253 HydrophobicContact CG1-CG 4.34Å |
| 247 | Q | 88.3 | Confident | 83.5 | Confident | 52 Ų | 52 | 53.2 Ų | 53.2 | 24% | 0.243 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -52.9 | -40.4 | 175.3 | 174.2 | -172.3 | -3.5 | 0 | 0 | 112.8 | E243 V249 Y253 Y260 | E243-Q247 PolarHBondContact O-N 2.71Å; Q247-V249 PolarHBondContact O-N 3.42Å; Q247-Y253 HydrophobicContact CB-CD1 4.13Å; Q247-Y260 HydrophobicContact CG-CD1 4.26Å; Q247-Y260 HydrophobicContact CG-CG 4.08Å |
| 248 | K | 84.6 | Confident | 83.4 | Confident | 68 Ų | 68 | 48 Ų | 48 | 30% | 0.296 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -11.7 | 179.7 | -72.3 | 175.6 | 179.6 | -177.3 | 0 | 113.7 | E205 L208 S209 S244 L245 V246 | E205-K248 IonicContact OE1-NZ 2.83Å; E205-K248 PolarHBondContact OE1-NZ 3.38Å; L208-K248 HydrophobicContact CB-CB 4.32Å; L208-K248 HydrophobicContact CD1-CB 4.4Å; S209-K248 WeakPolarHBondContact OG-CE 3.33Å; S209-K248 PolarHBondContact OG-NZ 3.27Å; S244-K248 WeakPolarHBondContact O-CG 3.41Å; S244-K248 PolarHBondContact O-N 3.34Å; L245-K248 PolarHBondContact O-N 3.07Å; V246-K248 VanDerWaalsContact C-N 3.26Å; V246-K248 PolarHBondContact O-N 3.47Å |
| 249 | V | 86.6 | Confident | 83 | Confident | 31 Ų | 31 | 52.4 Ų | 52.4 | 19% | 0.188 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -116.7 | -25.5 | -176.7 | -177.1 | 0 | 0 | 0 | 0 | 112.7 | L208 V215 T220 L223 V246 Q247 | L208-V249 HydrophobicContact CD1-CG2 3.82Å; L208-V249 HydrophobicContact CD2-CG2 3.78Å; L208-V249 HydrophobicContact CG-CG2 4.43Å; V215-V249 HydrophobicContact CB-CG1 4.28Å; V215-V249 HydrophobicContact CG1-CG1 3.73Å; V215-V249 HydrophobicContact CG1-CG2 4.05Å; V215-V249 HydrophobicContact CG2-CG1 4.49Å; V215-V249 HydrophobicContact CG2-CG2 4.21Å; T220-V249 HydrophobicContact CG2-CG1 3.72Å; T220-V249 WeakPolarHBondContact OG1-CG1 3.26Å; L223-V249 HydrophobicContact CD1-CB 4.25Å; L223-V249 HydrophobicContact CD1-CG2 3.69Å; V246-V249 PolarHBondContact O-N 2.96Å; Q247-V249 PolarHBondContact O-N 3.42Å |
| 250 | V | 85.8 | Confident | 82.2 | Confident | 38 Ų | 38 | 54.1 Ų | 54.1 | 23% | 0.23 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -125.8 | 122.6 | -175.7 | -177.8 | 0 | 0 | 0 | 0 | 109.1 | T220 L224 V246 Y253 | T220-V250 HydrophobicContact CG2-CG2 3.96Å; L224-V250 HydrophobicContact CD1-CG2 4.42Å; L224-V250 HydrophobicContact CD2-CG2 4.23Å; L224-V250 HydrophobicContact CG-CG2 4.4Å; V246-V250 HydrophobicContact CG1-CB 4.4Å; V246-V250 HydrophobicContact CG1-CG2 4.26Å; V246-V250 PolarHBondContact O-N 2.85Å; V250-Y253 WeakPolarHBondContact O-CB 3.18Å |
| 251 | S | 81.5 | Confident | 80.8 | Confident | 89 Ų | 89 | 55.8 Ų | 55.8 | 62% | 0.622 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -136.1 | 131.5 | 177.4 | -178.8 | 0 | 0 | 0 | 0 | 110.3 | ||
| 252 | P | 83.2 | Confident | 79.4 | Confident | 102 Ų | 102 | 53 Ų | 53 | 66% | 0.662 | 32% | 0.317 | S | S | * | . | S | Bend | cis | -71.6 | 148.7 | -7.9 | 31.8 | -35.2 | 0 | 0 | 0 | 111.8 | ||
| 253 | Y | 83.8 | Confident | 77.6 | Confident | 9 Ų | 9 | 61.3 Ų | 61.3 | 4% | 0.035 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 140.5 | 174.4 | 176 | -109.4 | 0 | 0 | 0 | 110.8 | Q227 E243 V246 Q247 V250 G255 Y260 | Q227-Y253 VanDerWaalsContact CD-OH 3.24Å; Q227-Y253 PolarHBondContact NE2-OH 3.44Å; E243-Y253 HydrophobicContact CB-CE1 4.07Å; E243-Y253 WeakPolarHBondContact CG-OH 3.36Å; E243-Y253 PolarHBondContact OE1-OH 3.42Å; V246-Y253 HydrophobicContact CB-CD2 4.41Å; V246-Y253 HydrophobicContact CB-CE2 3.98Å; V246-Y253 HydrophobicContact CG1-CD2 3.58Å; V246-Y253 HydrophobicContact CG1-CE2 3.32Å; V246-Y253 HydrophobicContact CG1-CG 4.34Å; Q247-Y253 HydrophobicContact CB-CD1 4.13Å; V250-Y253 WeakPolarHBondContact O-CB 3.18Å; Y253-G255 VanDerWaalsContact CE1-CA 3.47Å; Y253-Y260 AromaticContact CD1-CD2 3.73Å; Y253-Y260 HydrophobicContact CD1-CD2 3.73Å; Y253-Y260 HydrophobicContact CD1-CE2 4.3Å; Y253-Y260 HydrophobicContact CD1-CG 4.49Å; Y253-Y260 HydrophobicContact CE1-CD2 4.3Å; Y253-Y260 HydrophobicContact CE1-CE2 4.44Å; Y253-Y260 PolarHBondContact N-O 3.49Å; Y253-Y260 VanDerWaalsContact N-O 3.14Å; Y253-Y260 PolarHBondContact O-N 2.91Å |
| 254 | L | 81.6 | Confident | 76.2 | Confident | 118 Ų | 118 | 68.8 Ų | 68.8 | 62% | 0.618 | 39% | 0.39 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 100.6 | 174.2 | 179 | 61.2 | 0 | 0 | 0 | 108.3 | L259 | L254-L259 HydrophobicContact CB-CD2 4.03Å; L254-L259 HydrophobicContact CD1-CD2 3.9Å; L254-L259 HydrophobicContact CD1-CG 4.04Å; L254-L259 HydrophobicContact CG-CD2 4.46Å |
| 255 | G | 81 | Confident | 74.2 | Confident | 10 Ų | 10 | 74.3 Ų | 74.3 | 10% | 0.103 | 42% | 0.418 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | -173.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | Y253 H257 G258 | Y253-G255 VanDerWaalsContact CE1-CA 3.47Å; G255-H257 PolarHBondContact O-N 2.96Å; G255-G258 PolarHBondContact N-O 2.95Å; G255-G258 PolarHBondContact O-N 3.25Å |
| 256 | T | 77.6 | Confident | 71.8 | Confident | 72 Ų | 72 | 80.6 Ų | 80.6 | 44% | 0.442 | 45% | 0.451 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -30.1 | -179.7 | 51.2 | 0 | 0 | 0 | 0 | 114.1 | Y239 L240 E243 | Y239-T256 HydrophobicContact CE1-CG2 3.88Å; L240-T256 VanDerWaalsContact CD2-OG1 3.28Å; L240-T256 WeakPolarHBondContact CD2-OG1 3.38Å; E243-T256 PolarHBondContact OE1-N 3.5Å; E243-T256 WeakPolarHBondContact OE2-CB 3.4Å; E243-T256 WeakPolarHBondContact OE2-CG2 3.42Å; E243-T256 PolarHBondContact OE2-N 3Å; E243-T256 PolarHBondContact OE2-OG1 2.89Å |
| 257 | H | 68.4 | Low | 69.6 | Low | 135 Ų | 135 | 87.8 Ų | 87.8 | 63% | 0.625 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.9 | 3 | 176.2 | -57.8 | -75.5 | 0 | 0 | 0 | 114.3 | G255 Y260 | G255-H257 PolarHBondContact O-N 2.96Å; H257-Y260 HydrophobicContact CB-CE2 4.49Å; H257-Y260 WeakPolarHBondContact CB-OH 3.38Å; H257-Y260 PolarHBondContact CD2-OH 3.01Å |
| 258 | G | 77.2 | Confident | 67.1 | Low | 26 Ų | 26 | 93.5 Ų | 93.5 | 27% | 0.268 | 52% | 0.516 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 112.7 | -155.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | G255 Y260 | G255-G258 PolarHBondContact N-O 2.95Å; G255-G258 PolarHBondContact O-N 3.25Å; G258-Y260 WeakPolarHBondContact O-CD2 3.43Å |
| 259 | L | 72.8 | Confident | 64.8 | Low | 134 Ų | 134 | 96.1 Ų | 96.1 | 70% | 0.702 | 54% | 0.542 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.3 | 121.8 | -179.3 | -75 | 172.7 | 0 | 0 | 0 | 110.9 | L254 | L254-L259 HydrophobicContact CB-CD2 4.03Å; L254-L259 HydrophobicContact CD1-CD2 3.9Å; L254-L259 HydrophobicContact CD1-CG 4.04Å; L254-L259 HydrophobicContact CG-CD2 4.46Å |
| 260 | Y | 65.8 | Low | 62.2 | Low | 54 Ų | 54 | 100.1 Ų | 100.1 | 21% | 0.212 | 57% | 0.57 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -101.7 | 103.5 | 171.1 | -64.5 | -86.3 | 0 | 0 | 0 | 109.9 | Q247 Y253 H257 G258 | Q247-Y260 HydrophobicContact CG-CD1 4.26Å; Q247-Y260 HydrophobicContact CG-CG 4.08Å; Y253-Y260 AromaticContact CD1-CD2 3.73Å; Y253-Y260 HydrophobicContact CD1-CD2 3.73Å; Y253-Y260 HydrophobicContact CD1-CE2 4.3Å; Y253-Y260 HydrophobicContact CD1-CG 4.49Å; Y253-Y260 HydrophobicContact CE1-CD2 4.3Å; Y253-Y260 HydrophobicContact CE1-CE2 4.44Å; Y253-Y260 PolarHBondContact N-O 3.49Å; Y253-Y260 VanDerWaalsContact N-O 3.14Å; Y253-Y260 PolarHBondContact O-N 2.91Å; H257-Y260 HydrophobicContact CB-CE2 4.49Å; H257-Y260 WeakPolarHBondContact CB-OH 3.38Å; H257-Y260 PolarHBondContact CD2-OH 3.01Å; G258-Y260 WeakPolarHBondContact O-CD2 3.43Å |
| 261 | S | 55.8 | Low | 60.1 | Low | 76 Ų | 76 | 104.3 Ų | 104.3 | 53% | 0.531 | 60% | 0.595 | S | S | . | * | trans | -89 | 126.7 | 158 | 41.5 | 0 | 0 | 0 | 0 | 108.2 | E263 | S261-E263 PolarHBondContact O-N 3.5Š| ||
| 262 | G | 55.5 | Low | 58 | Low | 59 Ų | 59 | 108 Ų | 108 | 61% | 0.608 | 60% | 0.6 | S | S | * | * | trans | -73.2 | 64.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 263 | E | 49 | Very low | 55.9 | Low | 174 Ų | 174 | 107.3 Ų | 107.3 | 81% | 0.813 | 59% | 0.591 | S | S | * | * | trans | -99.6 | 74.7 | 170.5 | -69.9 | -178 | 143.1 | 0 | 0 | 109.7 | S261 | S261-E263 PolarHBondContact O-N 3.5Š| ||
| 264 | E | 58.1 | Low | 53.8 | Low | 160 Ų | 160 | 114 Ų | 114 | 75% | 0.748 | 62% | 0.62 | S | S | * | * | trans | -92.8 | 89.2 | 151.1 | -72.6 | -177.6 | 162.9 | 0 | 0 | 106.8 | ||||
| 265 | D | 45.9 | Very low | 51.6 | Low | 147 Ų | 147 | 117.6 Ų | 117.6 | 79% | 0.786 | 63% | 0.625 | S | S | * | * | trans | -171.2 | 137.3 | 142.9 | -100.1 | -19.7 | 0 | 0 | 0 | 114 | ||||
| 266 | D | 36.7 | Very low | 49.2 | Very low | 139 Ų | 139 | 122.8 Ų | 122.8 | 74% | 0.743 | 66% | 0.655 | S | S | * | * | trans | 63.5 | 141.7 | 147.1 | -75.8 | -37.8 | 0 | 0 | 0 | 124.8 | H268 | D266-H268 VanDerWaalsContact C-N 3.25Å; D266-H268 PolarHBondContact O-N 2.95Å | ||
| 267 | D | 43.5 | Very low | 47.1 | Very low | 150 Ų | 150 | 124.4 Ų | 124.4 | 80% | 0.802 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -74.5 | 61 | -178.1 | -168.1 | 20.6 | 0 | 0 | 0 | 112.7 | ||
| 268 | H | 35.4 | Very low | 45.5 | Very low | 172 Ų | 172 | 130.3 Ų | 130.3 | 80% | 0.796 | 68% | 0.683 | S | S | * | * | trans | -135.1 | 97.5 | 172.1 | -82.4 | -34.6 | 0 | 0 | 0 | 113.1 | D266 C270 | D266-H268 VanDerWaalsContact C-N 3.25Å; D266-H268 PolarHBondContact O-N 2.95Å; H268-C270 PolarHBondContact O-N 3.24Å | ||
| 269 | C | 36.6 | Very low | 43.4 | Very low | 124 Ų | 124 | 131.7 Ų | 131.7 | 84% | 0.838 | 70% | 0.698 | S | S | * | * | trans | -42.2 | 100.3 | 170.2 | -76.1 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 270 | C | 31.9 | Very low | 41.4 | Very low | 115 Ų | 115 | 137.1 Ų | 137.1 | 78% | 0.777 | 71% | 0.709 | S | S | * | * | trans | -115.8 | 92 | 153.9 | -81.5 | 0 | 0 | 0 | 0 | 108.5 | H268 F272 | H268-C270 PolarHBondContact O-N 3.24Å; C270-F272 PolarHBondContact O-N 3.38Å | ||
| 271 | V | 41.7 | Very low | 39.8 | Very low | 125 Ų | 125 | 141 Ų | 141 | 76% | 0.758 | 74% | 0.741 | S | S | * | * | trans | -60.9 | 94.9 | 174.7 | 175.6 | 0 | 0 | 0 | 0 | 109.4 | D273 | V271-D273 HydrophobicContact CG1-CB 3.69Å; V271-D273 PolarHBondContact O-N 2.82Å | ||
| 272 | F | 36.6 | Very low | 38.7 | Very low | 168 Ų | 168 | 147.1 Ų | 147.1 | 74% | 0.737 | 76% | 0.758 | S | S | * | * | trans | -87.6 | 57 | 160.1 | -113.4 | -90.9 | 0 | 0 | 0 | 110.2 | C270 K274 | C270-F272 PolarHBondContact O-N 3.38Å; F272-K274 HydrophobicContact CD1-CB 4.13Å; F272-K274 HydrophobicContact CD1-CD 4.27Å; F272-K274 HydrophobicContact CD1-CG 4.2Å; F272-K274 HydrophobicContact CE1-CB 4.45Å; F272-K274 HydrophobicContact CE1-CD 3.84Å; F272-K274 HydrophobicContact CE1-CG 4.28Å; F272-K274 PolarHBondContact O-N 2.74Å | ||
| 273 | D | 39.8 | Very low | 37.7 | Very low | 87 Ų | 87 | 149.5 Ų | 149.5 | 47% | 0.465 | 77% | 0.766 | S | S | . | * | trans | -67.5 | 76.8 | 151.7 | -174.8 | 7.2 | 0 | 0 | 0 | 108.3 | V271 R275 | V271-D273 HydrophobicContact CG1-CB 3.69Å; V271-D273 PolarHBondContact O-N 2.82Å; D273-R275 WeakPolarHBondContact OD1-CG 3.46Å; D273-R275 IonicContact OD1-CZ 3.5Å; D273-R275 IonicContact OD1-NE 3.51Å; D273-R275 PolarHBondContact OD1-NE 3.45Å; D273-R275 IonicContact OD1-NH2 2.68Å; D273-R275 IonicContact OD2-CZ 2.7Å; D273-R275 IonicContact OD2-NE 3.58Å; D273-R275 IonicContact OD2-NH2 3.63Å; D273-R275 PolarHBondContact OD2-NH2 3.45Å | ||
| 274 | K | 39.6 | Very low | 37 | Very low | 150 Ų | 150 | 145.7 Ų | 145.7 | 65% | 0.652 | 76% | 0.764 | S | S | * | * | trans | -122.8 | 69.1 | 153.3 | -67.6 | -170.7 | -174.9 | 169.6 | 0 | 107.6 | F272 V276 | F272-K274 HydrophobicContact CD1-CB 4.13Å; F272-K274 HydrophobicContact CD1-CD 4.27Å; F272-K274 HydrophobicContact CD1-CG 4.2Å; F272-K274 HydrophobicContact CE1-CB 4.45Å; F272-K274 HydrophobicContact CE1-CD 3.84Å; F272-K274 HydrophobicContact CE1-CG 4.28Å; F272-K274 PolarHBondContact O-N 2.74Å; K274-V276 PolarHBondContact O-N 2.67Å; K274-V276 VanDerWaalsContact O-N 3.08Å | ||
| 275 | R | 35.7 | Very low | 35.8 | Very low | 193 Ų | 193 | 145.9 Ų | 145.9 | 73% | 0.728 | 77% | 0.77 | S | S | * | * | trans | -29 | 115.9 | 131.8 | -77.7 | 176.5 | -88.6 | -168.2 | -9.2 | 108 | D273 P277 | D273-R275 WeakPolarHBondContact OD1-CG 3.46Å; D273-R275 IonicContact OD1-CZ 3.5Å; D273-R275 IonicContact OD1-NE 3.51Å; D273-R275 PolarHBondContact OD1-NE 3.45Å; D273-R275 IonicContact OD1-NH2 2.68Å; D273-R275 IonicContact OD2-CZ 2.7Å; D273-R275 IonicContact OD2-NE 3.58Å; D273-R275 IonicContact OD2-NH2 3.63Å; D273-R275 PolarHBondContact OD2-NH2 3.45Å; R275-P277 WeakPolarHBondContact O-CD 3.33Å; R275-P277 WeakPolarHBondContact O-CG 3.1Å | ||
| 276 | V | 30.4 | Very low | 35.5 | Very low | 119 Ų | 119 | 147.4 Ų | 147.4 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | trans | -65.6 | 106.1 | 175 | -177.7 | 0 | 0 | 0 | 0 | 106.9 | K274 W278 | K274-V276 PolarHBondContact O-N 2.67Å; K274-V276 VanDerWaalsContact O-N 3.08Å; V276-W278 PolarHBondContact O-N 3.02Å | ||
| 277 | P | 33.8 | Very low | 35.8 | Very low | 106 Ų | 106 | 145.9 Ų | 145.9 | 69% | 0.688 | 77% | 0.77 | S | S | * | * | trans | -81.2 | 113.2 | 172.6 | 2.6 | 20 | 0 | 0 | 0 | 104.4 | R275 G279 | R275-P277 WeakPolarHBondContact O-CD 3.33Å; R275-P277 WeakPolarHBondContact O-CG 3.1Å; P277-G279 PolarHBondContact O-N 3.01Å | ||
| 278 | W | 33.5 | Very low | 35.3 | Very low | 258 Ų | 258 | 144.1 Ų | 144.1 | 98% | 0.977 | 77% | 0.77 | S | S | * | * | trans | -68 | 75.4 | 161.3 | -87.1 | 89.4 | 0 | 0 | 0 | 108.3 | V276 | V276-W278 PolarHBondContact O-N 3.02Š| ||
| 279 | G | 33.3 | Very low | 35.2 | Very low | 56 Ų | 56 | 145.7 Ų | 145.7 | 58% | 0.577 | 77% | 0.774 | S | S | * | * | trans | -133.4 | 119.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | P277 | P277-G279 PolarHBondContact O-N 3.01Š| ||
| 280 | W | 31.1 | Very low | 35 | Very low | 248 Ų | 248 | 147.3 Ų | 147.3 | 94% | 0.939 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 143.6 | -177.7 | -65.5 | -16.5 | 0 | 0 | 0 | 112.6 | K282 | W280-K282 PolarHBondContact O-N 3.34Š|
| 281 | P | 32.5 | Very low | 36 | Very low | 135 Ų | 135 | 147 Ų | 147 | 88% | 0.877 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 119.8 | 173 | 28.6 | -33.1 | 0 | 0 | 0 | 109.9 | ||
| 282 | K | 32.7 | Very low | 35.5 | Very low | 204 Ų | 204 | 146.9 Ų | 146.9 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -100.7 | 120.3 | 167.2 | -153.2 | 172.6 | -173.1 | 177.8 | 0 | 108.4 | W280 | W280-K282 PolarHBondContact O-N 3.34Š|
| 283 | S | 32.9 | Very low | 35.4 | Very low | 110 Ų | 110 | 144.1 Ų | 144.1 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 141.4 | -178.9 | 178.4 | 0 | 0 | 0 | 0 | 112.1 | ||
| 284 | A | 35.3 | Very low | 35.5 | Very low | 94 Ų | 94 | 151 Ų | 151 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 120.6 | 161.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||
| 285 | D | 33.6 | Very low | 35.7 | Very low | 164 Ų | 164 | 149.1 Ų | 149.1 | 88% | 0.877 | 79% | 0.792 | S | S | * | * | trans | -151.2 | 147.3 | 151.5 | -125.1 | -26.1 | 0 | 0 | 0 | 110 | ||||
| 286 | Q | 38.2 | Very low | 36 | Very low | 178 Ų | 178 | 149.6 Ų | 149.6 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -101 | -174.7 | -170.7 | -131.9 | -153.6 | 15.5 | 0 | 0 | 111.6 | ||||
| 287 | P | 44.6 | Very low | 36.3 | Very low | 108 Ų | 108 | 148 Ų | 148 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | -107.7 | 141.3 | -126.7 | 36.1 | -21.2 | 0 | 0 | 0 | 114.8 | |||||
| 288 | S | 32.4 | Very low | 36.5 | Very low | 113 Ų | 113 | 152.6 Ų | 152.6 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -156.4 | 122.2 | 149.7 | 51.4 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 289 | K | 33.3 | Very low | 36.5 | Very low | 204 Ų | 204 | 145.9 Ų | 145.9 | 89% | 0.887 | 78% | 0.782 | S | S | * | * | trans | 45.1 | 96.5 | 143.4 | -57.9 | 177.6 | -176.9 | 175.7 | 0 | 120 | ||||
| 290 | N | 32.1 | Very low | 36.7 | Very low | 159 Ų | 159 | 150.3 Ų | 150.3 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | 7.5 | 159 | 130.3 | -89.9 | -15.6 | 0 | 0 | 0 | 120.5 | ||||
| 291 | P | 52.8 | Low | 37.3 | Very low | 107 Ų | 107 | 143.3 Ų | 143.3 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | cis | -136.8 | -165.8 | -41.5 | 37.5 | -17.9 | 0 | 0 | 0 | 111 | ||||
| 292 | V | 30.7 | Very low | 37.9 | Very low | 124 Ų | 124 | 144.3 Ų | 144.3 | 75% | 0.752 | 77% | 0.774 | S | S | * | * | trans | 143.1 | 112.7 | 146.3 | 163.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 293 | V | 35.6 | Very low | 38.2 | Very low | 110 Ų | 110 | 142 Ų | 142 | 67% | 0.667 | 77% | 0.771 | S | S | * | * | trans | 53.7 | 125.5 | 138.8 | -179.7 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 294 | R | 42.2 | Very low | 38.8 | Very low | 231 Ų | 231 | 145.2 Ų | 145.2 | 87% | 0.872 | 78% | 0.779 | S | S | * | * | cis | -157.7 | 146.5 | 36.3 | -148.4 | 158 | -167.8 | 106.8 | -3.8 | 112 | ||||
| 295 | S | 43.7 | Very low | 38.8 | Very low | 111 Ų | 111 | 146.3 Ų | 146.3 | 78% | 0.776 | 78% | 0.776 | S | S | * | * | trans | -86.8 | 145.6 | 177.6 | -37.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 296 | K | 40.9 | Very low | 39.1 | Very low | 203 Ų | 203 | 144 Ų | 144 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | trans | 179.3 | 113.6 | 143.3 | -100.8 | 171.3 | -178.8 | -172.5 | 0 | 107.7 | ||||
| 297 | S | 37.5 | Very low | 39 | Very low | 84 Ų | 84 | 142 Ų | 142 | 59% | 0.587 | 77% | 0.77 | S | S | * | * | cis | 111.8 | 132.5 | 20.5 | 68.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 298 | Y | 38 | Very low | 38.9 | Very low | 203 Ų | 203 | 141.3 Ų | 141.3 | 80% | 0.796 | 77% | 0.773 | S | S | * | * | trans | 80.9 | 103.1 | 176.3 | -56.2 | -81.4 | 0 | 0 | 0 | 115.3 | ||||
| 299 | N | 33.9 | Very low | 39.2 | Very low | 118 Ų | 118 | 144.9 Ų | 144.9 | 63% | 0.631 | 78% | 0.777 | S | S | * | * | 84.1 | 106.9 | 78.7 | -85.5 | -71.3 | 0 | 0 | 0 | 110.7 | |||||
| 300 | I | 36.6 | Very low | 39 | Very low | 148 Ų | 148 | 145.5 Ų | 145.5 | 76% | 0.759 | 78% | 0.775 | S | S | * | * | 67.8 | 135.5 | 78.1 | -67.1 | 175.5 | 0 | 0 | 0 | 111.1 | |||||
| 301 | P | 44.7 | Very low | 39.3 | Very low | 101 Ų | 101 | 145.1 Ų | 145.1 | 66% | 0.656 | 77% | 0.773 | S | S | * | * | cis | -132.4 | -170.6 | 8.8 | 35.1 | -13.4 | 0 | 0 | 0 | 115.3 | ||||
| 302 | L | 43.4 | Very low | 38.9 | Very low | 156 Ų | 156 | 144.7 Ų | 144.7 | 82% | 0.817 | 77% | 0.77 | S | S | * | * | trans | 30.4 | 117.7 | 140 | -65.3 | 160.6 | 0 | 0 | 0 | 119.2 | ||||
| 303 | L | 39 | Very low | 39.3 | Very low | 157 Ų | 157 | 145.8 Ų | 145.8 | 82% | 0.822 | 77% | 0.772 | S | S | * | * | -175 | 129.5 | 110.3 | -97.7 | 160.1 | 0 | 0 | 0 | 110.7 | |||||
| 304 | L | 46.1 | Very low | 39.6 | Very low | 177 Ų | 177 | 146 Ų | 146 | 93% | 0.927 | 78% | 0.776 | S | S | * | * | trans | -67.8 | 126 | 154.9 | -78.6 | 151.4 | 0 | 0 | 0 | 107.2 | ||||
| 305 | T | 36.6 | Very low | 39.1 | Very low | 116 Ų | 116 | 140.3 Ų | 140.3 | 71% | 0.712 | 77% | 0.771 | S | S | * | * | trans | -128.6 | 133 | 164.3 | -51.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 306 | P | 37.9 | Very low | 38.7 | Very low | 115 Ų | 115 | 140.5 Ų | 140.5 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | trans | -64.4 | 158.2 | -172.6 | -19.9 | 32.5 | 0 | 0 | 0 | 112.5 | A308 | P306-A308 PolarHBondContact O-N 3.18Š| ||
| 307 | V | 38 | Very low | 38.6 | Very low | 138 Ų | 138 | 135.7 Ų | 135.7 | 84% | 0.836 | 77% | 0.771 | S | S | * | * | trans | -58.8 | 109.6 | 164.6 | 174.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 308 | A | 41.7 | Very low | 38.5 | Very low | 93 Ų | 93 | 135.7 Ų | 135.7 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | -86.4 | 113.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108 | P306 | P306-A308 PolarHBondContact O-N 3.18Š| ||
| 309 | E | 37.8 | Very low | 38.4 | Very low | 187 Ų | 187 | 132.5 Ų | 132.5 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | trans | -69.8 | 136.6 | 162.3 | -69.1 | -177.5 | 148.3 | 0 | 0 | 108.6 | ||||
| 310 | Y | 31 | Very low | 38.6 | Very low | 217 Ų | 217 | 129.9 Ų | 129.9 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -98.8 | 118.6 | -175.4 | -175.4 | -85.1 | 0 | 0 | 0 | 108.9 | ||||
| 311 | D | 38.3 | Very low | 38.6 | Very low | 151 Ų | 151 | 126.7 Ų | 126.7 | 81% | 0.807 | 80% | 0.795 | S | S | * | * | trans | -126.4 | 127.2 | 174.2 | -163.3 | 20.2 | 0 | 0 | 0 | 109.2 | D313 | D311-D313 PolarHBondContact O-N 3.27Š| ||
| 312 | P | 43.5 | Very low | 38.6 | Very low | 98 Ų | 98 | 129.2 Ų | 129.2 | 64% | 0.636 | 80% | 0.802 | S | S | * | * | trans | -85.4 | 108.4 | -179.2 | 31.5 | -33.5 | 0 | 0 | 0 | 113.1 | ||||
| 313 | D | 38.7 | Very low | 38.6 | Very low | 148 Ų | 148 | 132 Ų | 132 | 79% | 0.791 | 80% | 0.802 | S | S | * | * | trans | -55.2 | 154.1 | 158.2 | -104.8 | -41.7 | 0 | 0 | 0 | 111.4 | D311 | D311-D313 PolarHBondContact O-N 3.27Š| ||
| 314 | P | 43.2 | Very low | 39.2 | Very low | 115 Ų | 115 | 136.1 Ų | 136.1 | 75% | 0.747 | 81% | 0.806 | S | S | * | * | cis | -147.3 | 147.6 | 45.2 | 38.6 | -18.2 | 0 | 0 | 0 | 118.6 | ||||
| 315 | S | 31.4 | Very low | 39.3 | Very low | 110 Ų | 110 | 135 Ų | 135 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | 156.6 | 142.5 | 106.7 | 58.4 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 316 | S | 34.5 | Very low | 40.1 | Very low | 115 Ų | 115 | 135.4 Ų | 135.4 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | 84.1 | 91 | 155.1 | -151.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 317 | A | 38.6 | Very low | 40.4 | Very low | 103 Ų | 103 | 134 Ų | 134 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | trans | 55.3 | 112.3 | 131.2 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 318 | G | 35.3 | Very low | 40.3 | Very low | 83 Ų | 83 | 133.1 Ų | 133.1 | 86% | 0.856 | 80% | 0.8 | S | S | * | * | trans | 161.5 | 104.1 | 158.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 319 | S | 36 | Very low | 40.2 | Very low | 137 Ų | 137 | 137.5 Ų | 137.5 | 96% | 0.958 | 81% | 0.805 | S | S | * | * | trans | -86.9 | 146.8 | -177.5 | -175.2 | 0 | 0 | 0 | 0 | 113 | ||||
| 320 | G | 39.1 | Very low | 40.2 | Very low | 63 Ų | 63 | 136.1 Ų | 136.1 | 65% | 0.649 | 80% | 0.802 | S | S | * | * | trans | 134.8 | 38.4 | 160.9 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 321 | G | 35.5 | Very low | 40.3 | Very low | 80 Ų | 80 | 132.7 Ų | 132.7 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | trans | -94.3 | 103.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | R323 | G321-R323 PolarHBondContact O-N 3Š| ||
| 322 | I | 45.4 | Very low | 40 | Very low | 154 Ų | 154 | 130.5 Ų | 130.5 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | trans | -73.9 | 113.8 | 170.1 | -68.3 | 79.7 | 0 | 0 | 0 | 109.4 | ||||
| 323 | R | 44 | Very low | 39.3 | Very low | 216 Ų | 216 | 131.6 Ų | 131.6 | 82% | 0.815 | 80% | 0.802 | S | S | * | * | trans | -89 | 118.4 | 165 | -79.7 | -170.7 | -178.5 | -127.7 | 1.5 | 110.7 | G321 H325 | G321-R323 PolarHBondContact O-N 3Å; R323-H325 PolarHBondContact O-N 3.09Å | ||
| 324 | R | 49.8 | Very low | 39.2 | Very low | 243 Ų | 243 | 132.6 Ų | 132.6 | 92% | 0.917 | 81% | 0.806 | S | S | * | * | trans | -79.5 | 111.7 | 169.7 | -74.8 | 174.4 | 152.4 | 169.2 | -8.1 | 109.4 | ||||
| 325 | H | 49.6 | Very low | 38.6 | Very low | 154 Ų | 154 | 134.4 Ų | 134.4 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -99.6 | 121.1 | 164.5 | -62.3 | -80.5 | 0 | 0 | 0 | 108 | R323 A327 | R323-H325 PolarHBondContact O-N 3.09Å; H325-A327 PolarHBondContact O-N 3.36Å | ||
| 326 | S | 53.6 | Low | 38.7 | Very low | 124 Ų | 124 | 138.6 Ų | 138.6 | 87% | 0.867 | 81% | 0.812 | S | S | * | * | trans | -73.8 | 111.2 | 179.5 | -171.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 327 | A | 44.4 | Very low | 38.6 | Very low | 85 Ų | 85 | 141 Ų | 141 | 70% | 0.702 | 81% | 0.811 | S | S | * | * | trans | -96.8 | 131.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | H325 E329 | H325-A327 PolarHBondContact O-N 3.36Å; A327-E329 PolarHBondContact O-N 3.24Å | ||
| 328 | C | 34.3 | Very low | 38.1 | Very low | 120 Ų | 120 | 139.5 Ų | 139.5 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | -78.4 | 114.8 | 171.3 | -60 | 0 | 0 | 0 | 0 | 108.8 | I330 | C328-I330 PolarHBondContact O-N 2.91Š| ||
| 329 | E | 41 | Very low | 37.9 | Very low | 185 Ų | 185 | 144.1 Ų | 144.1 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | -71.8 | 116 | 175.9 | -68.1 | 178.8 | 156.3 | 0 | 0 | 110 | A327 | A327-E329 PolarHBondContact O-N 3.24Š| ||
| 330 | I | 38 | Very low | 37.7 | Very low | 158 Ų | 158 | 143.6 Ų | 143.6 | 81% | 0.81 | 80% | 0.8 | S | S | * | * | trans | -90.3 | 106.5 | 170.9 | -55.3 | 171.9 | 0 | 0 | 0 | 106.6 | C328 S332 | C328-I330 PolarHBondContact O-N 2.91Å; I330-S332 PolarHBondContact O-N 2.69Å | ||
| 331 | I | 32.7 | Very low | 37.3 | Very low | 145 Ų | 145 | 151.4 Ų | 151.4 | 74% | 0.744 | 81% | 0.811 | S | S | * | * | trans | -77.6 | 93.3 | 177.6 | -55 | 175.2 | 0 | 0 | 0 | 108.7 | C333 | I331-C333 PolarHBondContact O-N 2.98Š| ||
| 332 | S | 31.7 | Very low | 37.1 | Very low | 105 Ų | 105 | 151.1 Ų | 151.1 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | trans | -82 | 105.7 | 164.2 | 57.3 | 0 | 0 | 0 | 0 | 109.3 | I330 L334 | I330-S332 PolarHBondContact O-N 2.69Å; S332-L334 PolarHBondContact O-N 2.87Å | ||
| 333 | C | 29.4 | Very low | 36.4 | Very low | 121 Ų | 121 | 151 Ų | 151 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 117.4 | 174.8 | -63 | 0 | 0 | 0 | 0 | 110.1 | I331 | I331-C333 PolarHBondContact O-N 2.98Š|
| 334 | L | 35.8 | Very low | 35.9 | Very low | 168 Ų | 168 | 148.1 Ų | 148.1 | 88% | 0.88 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 134.5 | 175.5 | -162.7 | 75.6 | 0 | 0 | 0 | 110.1 | S332 | S332-L334 PolarHBondContact O-N 2.87Š|
| 335 | E | 31.5 | Very low | 35 | Very low | 154 Ų | 154 | 140.8 Ų | 140.8 | 72% | 0.72 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 124.3 | 172.1 | -179.6 | 176.6 | -171.4 | 0 | 0 | 110 | ||
| 336 | E | 32.4 | Very low | 34.8 | Very low | 197 Ų | 197 | 139.9 Ų | 139.9 | 92% | 0.921 | 80% | 0.802 | S | S | * | * | trans | -117 | 106.4 | 172.7 | -167.2 | 172.2 | -159.1 | 0 | 0 | 109.7 | ||||
| 337 | Q | 32.5 | Very low | 33.5 | Very low | 167 Ų | 167 | 137.6 Ų | 137.6 | 78% | 0.78 | 80% | 0.798 | S | S | * | * | trans | -127.4 | 119.1 | 175.4 | -103.9 | 177.7 | 53.4 | 0 | 0 | 111.2 | ||||
| 338 | G | 28.9 | Very low | 32.8 | Very low | 70 Ų | 70 | 138.9 Ų | 138.9 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | trans | 100.1 | 116.8 | 158.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 339 | L | 30.9 | Very low | 32.6 | Very low | 180 Ų | 180 | 141 Ų | 141 | 94% | 0.942 | 80% | 0.799 | S | S | * | * | -163.8 | 124.5 | 111.5 | -100.9 | 169 | 0 | 0 | 0 | 111.1 | |||||
| 340 | T | 30.6 | Very low | 32.3 | Very low | 126 Ų | 126 | 139 Ų | 139 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | -94.8 | 129.1 | 175.1 | 48.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 341 | Y | 31.5 | Very low | 31.9 | Very low | 227 Ų | 227 | 136.9 Ų | 136.9 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -167.7 | 145.2 | 130.2 | -136.6 | -112.8 | 0 | 0 | 0 | 115.9 | ||||
| 342 | A | 31 | Very low | 31.7 | Very low | 74 Ų | 74 | 133.4 Ų | 133.4 | 61% | 0.612 | 79% | 0.793 | S | S | * | * | trans | 47.8 | 95.9 | 155.4 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 343 | N | 31.4 | Very low | 32.7 | Very low | 152 Ų | 152 | 134.5 Ų | 134.5 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | 58.4 | 149.5 | 98 | -141.6 | -4.8 | 0 | 0 | 0 | 122.7 | |||||
| 344 | L | 32.7 | Very low | 32.9 | Very low | 155 Ų | 155 | 134.3 Ų | 134.3 | 81% | 0.812 | 80% | 0.797 | S | S | * | * | trans | 87.4 | 101.6 | 168 | -52.4 | -179.5 | 0 | 0 | 0 | 120 | ||||
| 345 | A | 31 | Very low | 32.7 | Very low | 90 Ų | 90 | 131.3 Ų | 131.3 | 74% | 0.744 | 79% | 0.791 | S | S | * | * | trans | -82 | 177 | 142 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 346 | P | 45.1 | Very low | 32.6 | Very low | 135 Ų | 135 | 132 Ų | 132 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | cis | -139 | -179.3 | 12 | 42.7 | -24.2 | 0 | 0 | 0 | 116.4 | ||||
| 347 | G | 26.6 | Very low | 32.6 | Very low | 76 Ų | 76 | 133.1 Ų | 133.1 | 78% | 0.784 | 80% | 0.795 | S | S | * | * | trans | 165.2 | 113.9 | 161.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 348 | S | 30.5 | Very low | 32.5 | Very low | 111 Ų | 111 | 132.4 Ų | 132.4 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | trans | 34.1 | 120.1 | 146.4 | -88.7 | 0 | 0 | 0 | 0 | 125.3 | ||||
| 349 | E | 28.5 | Very low | 32.5 | Very low | 165 Ų | 165 | 134.2 Ų | 134.2 | 77% | 0.771 | 80% | 0.796 | S | S | * | * | 70.1 | 128.2 | 116.7 | -67.9 | -166.4 | 158.2 | 0 | 0 | 125.5 | |||||
| 350 | L | 35.7 | Very low | 32.4 | Very low | 144 Ų | 144 | 132.9 Ų | 132.9 | 75% | 0.754 | 80% | 0.795 | S | S | * | * | trans | 77.6 | 134 | 134.6 | -71.2 | 168.8 | 0 | 0 | 0 | 123.2 | ||||
| 351 | S | 29.3 | Very low | 32.2 | Very low | 113 Ų | 113 | 130.3 Ų | 130.3 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | trans | 81.3 | 124 | 151.2 | -55.2 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 352 | G | 27.9 | Very low | 32.1 | Very low | 72 Ų | 72 | 125.7 Ų | 125.7 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | trans | -94.8 | -150.2 | 149.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 353 | P | 53.7 | Low | 32.2 | Very low | 127 Ų | 127 | 130.7 Ų | 130.7 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | cis | -129.6 | 179.6 | -12.2 | 41.5 | -26.9 | 0 | 0 | 0 | 113 | ||||
| 354 | S | 32.6 | Very low | 32 | Very low | 117 Ų | 117 | 132 Ų | 132 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -169.4 | 138.7 | 143.1 | 38.1 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 355 | S | 32.5 | Very low | 31.9 | Very low | 106 Ų | 106 | 131 Ų | 131 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | trans | 23 | 126.9 | 151.5 | -59.3 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 356 | N | 30 | Very low | 31.6 | Very low | 168 Ų | 168 | 129.2 Ų | 129.2 | 90% | 0.898 | 79% | 0.79 | S | S | * | * | -153.1 | 151.3 | 88.8 | -88.6 | -33.7 | 0 | 0 | 0 | 112.2 | |||||
| 357 | R | 32.4 | Very low | 31 | Very low | 221 Ų | 221 | 130.4 Ų | 130.4 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | trans | -133.2 | 160.2 | -175.2 | -178.3 | -168.5 | -105.8 | -129.2 | 4.2 | 109.4 | ||||
| 358 | L | 28.9 | Very low | 31.2 | Very low | 151 Ų | 151 | 133.3 Ų | 133.3 | 79% | 0.791 | 78% | 0.784 | S | S | * | * | trans | 111.2 | 102.3 | 166.1 | -59.7 | 172 | 0 | 0 | 0 | 111.4 | ||||
| 359 | C | 29 | Very low | 31.3 | Very low | 108 Ų | 108 | 136.5 Ų | 136.5 | 73% | 0.73 | 79% | 0.786 | S | S | * | * | 77.1 | 98.6 | 55.1 | -60.7 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 360 | V | 29.1 | Very low | 31.3 | Very low | 152 Ų | 152 | 133.1 Ų | 133.1 | 92% | 0.921 | 79% | 0.787 | S | S | * | * | trans | -139.9 | 131.1 | 135.4 | 178.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 361 | G | 26.5 | Very low | 30.8 | Very low | 73 Ų | 73 | 130 Ų | 130 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -120.6 | 162.8 | 165.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 362 | S | 29.8 | Very low | 30.8 | Very low | 130 Ų | 130 | 130 Ų | 130 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | trans | -147.7 | 144.7 | 161 | -168.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 363 | Q | 33.6 | Very low | 30.9 | Very low | 179 Ų | 179 | 129.9 Ų | 129.9 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | trans | -139.7 | 145.8 | -169.7 | -167.8 | -177.2 | 61.3 | 0 | 0 | 109 | ||||
| 364 | F | 27.3 | Very low | 29.7 | Very low | 179 Ų | 179 | 127.9 Ų | 127.9 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | 74.1 | 137.7 | 164.7 | -133.7 | -127.3 | 0 | 0 | 0 | 115.2 | ||||
| 365 | N | 29.2 | Very low | 29.7 | Very low | 134 Ų | 134 | 130.7 Ų | 130.7 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | -160.6 | 171.6 | 51 | -154.7 | -18 | 0 | 0 | 0 | 110.6 | |||||
| 366 | G | 26.6 | Very low | 29.6 | Very low | 53 Ų | 53 | 133 Ų | 133 | 55% | 0.546 | 80% | 0.795 | S | S | . | * | trans | -121.2 | 171.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 367 | I | 32.2 | Very low | 29.5 | Very low | 159 Ų | 159 | 133.2 Ų | 133.2 | 82% | 0.815 | 80% | 0.796 | S | S | * | * | trans | 169.6 | 123.5 | 152 | -93.8 | 160.2 | 0 | 0 | 0 | 112.6 | ||||
| 368 | I | 31 | Very low | 29.5 | Very low | 138 Ų | 138 | 126.9 Ų | 126.9 | 71% | 0.708 | 79% | 0.79 | S | S | * | * | trans | 61.7 | 107.3 | 138.4 | -65.3 | -176 | 0 | 0 | 0 | 122.5 | ||||
| 369 | Q | 32.1 | Very low | 29.3 | Very low | 177 Ų | 177 | 126.1 Ų | 126.1 | 83% | 0.827 | 79% | 0.792 | S | S | * | * | 90.1 | 129.6 | 115.2 | -166.9 | 163.1 | 14.5 | 0 | 0 | 124.7 | |||||
| 370 | A | 28.1 | Very low | 29.3 | Very low | 94 Ų | 94 | 126 Ų | 126 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | trans | 83.1 | 127.8 | 143.8 | 0 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 371 | G | 25.7 | Very low | 29.5 | Very low | 80 Ų | 80 | 123.8 Ų | 123.8 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | trans | 89.5 | 147 | 148.5 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 372 | A | 29.3 | Very low | 30.1 | Very low | 112 Ų | 112 | 126.4 Ų | 126.4 | 93% | 0.926 | 79% | 0.787 | S | S | * | * | cis | -164.6 | 162.4 | -15.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 373 | G | 28.8 | Very low | 30 | Very low | 69 Ų | 69 | 125.5 Ų | 125.5 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | trans | 118.6 | 106.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 374 | A | 29.7 | Very low | 30 | Very low | 85 Ų | 85 | 124.9 Ų | 124.9 | 70% | 0.702 | 78% | 0.782 | S | S | * | * | 60.4 | 130 | 69.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 375 | M | 32.5 | Very low | 30.1 | Very low | 176 Ų | 176 | 123.8 Ų | 123.8 | 87% | 0.867 | 78% | 0.783 | S | S | * | * | cis | -155.7 | 163.5 | 20.3 | 30.2 | -93.4 | 146.1 | 0 | 0 | 111.4 | ||||
| 376 | D | 30.1 | Very low | 30.2 | Very low | 154 Ų | 154 | 126.5 Ų | 126.5 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -57 | 150.8 | 170.2 | -71.3 | -70.2 | 0 | 0 | 0 | 113.6 | ||||
| 377 | L | 27.7 | Very low | 30.4 | Very low | 174 Ų | 174 | 129.4 Ų | 129.4 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | -169.1 | 154.4 | 125.2 | -103.5 | 163.4 | 0 | 0 | 0 | 112.4 | |||||
| 378 | A | 32.1 | Very low | 30.4 | Very low | 87 Ų | 87 | 128 Ų | 128 | 72% | 0.719 | 81% | 0.808 | S | S | * | * | trans | -89 | -158.3 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 379 | V | 25.8 | Very low | 30.2 | Very low | 135 Ų | 135 | 124.8 Ų | 124.8 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | 96.5 | 133.7 | 177.2 | -179.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 380 | S | 28.5 | Very low | 30.1 | Very low | 106 Ų | 106 | 120.9 Ų | 120.9 | 74% | 0.741 | 81% | 0.807 | S | S | * | * | cis | -166 | 159.4 | -21.7 | -94.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 381 | S | 32.6 | Very low | 30.2 | Very low | 106 Ų | 106 | 124.8 Ų | 124.8 | 74% | 0.741 | 81% | 0.814 | S | S | * | * | trans | -69.6 | 157.6 | 166.3 | -46.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 382 | P | 39.2 | Very low | 30.5 | Very low | 127 Ų | 127 | 130.3 Ų | 130.3 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -102.1 | 117.9 | 154 | 33.3 | -24.2 | 0 | 0 | 0 | 110.8 | ||||
| 383 | S | 28.8 | Very low | 30.5 | Very low | 112 Ų | 112 | 128.1 Ų | 128.1 | 78% | 0.783 | 81% | 0.806 | S | S | * | * | trans | -118.8 | 126.5 | 164 | -58.8 | 0 | 0 | 0 | 0 | 108 | ||||
| 384 | I | 33.6 | Very low | 30.7 | Very low | 166 Ų | 166 | 131.7 Ų | 131.7 | 85% | 0.851 | 81% | 0.814 | S | S | * | * | trans | -90.2 | 135.9 | -178.3 | -67.1 | 177.5 | 0 | 0 | 0 | 109.8 | ||||
| 385 | L | 29.1 | Very low | 30.9 | Very low | 156 Ų | 156 | 136.4 Ų | 136.4 | 82% | 0.817 | 82% | 0.822 | S | S | * | * | trans | -74.9 | 147.7 | -176.2 | -72 | 154.2 | 0 | 0 | 0 | 112.9 | ||||
| 386 | H | 31.1 | Very low | 30.8 | Very low | 190 Ų | 190 | 133.2 Ų | 133.2 | 88% | 0.88 | 82% | 0.823 | S | S | * | * | trans | -129.9 | 132.1 | 146.4 | -89.1 | -89.2 | 0 | 0 | 0 | 109.8 | ||||
| 387 | S | 29.6 | Very low | 31 | Very low | 114 Ų | 114 | 131.8 Ų | 131.8 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | trans | -75.5 | 147.1 | -176.9 | -57.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 388 | S | 32.3 | Very low | 31.2 | Very low | 130 Ų | 130 | 129.7 Ų | 129.7 | 91% | 0.909 | 82% | 0.815 | S | S | * | * | trans | -164.5 | 148.5 | 133.6 | -81.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 389 | G | 27.7 | Very low | 31.2 | Very low | 71 Ų | 71 | 130.6 Ų | 130.6 | 73% | 0.732 | 81% | 0.811 | S | S | * | * | trans | -141.1 | 162.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 390 | A | 30.6 | Very low | 31.5 | Very low | 95 Ų | 95 | 130.6 Ų | 130.6 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | 64.3 | 131.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 391 | L | 30.1 | Very low | 31.8 | Very low | 176 Ų | 176 | 131.9 Ų | 131.9 | 92% | 0.921 | 82% | 0.815 | S | S | * | * | -153.2 | 176.9 | 52.5 | -87.1 | 166.9 | 0 | 0 | 0 | 114 | |||||
| 392 | H | 32.1 | Very low | 31.8 | Very low | 195 Ų | 195 | 133.1 Ų | 133.1 | 90% | 0.903 | 81% | 0.814 | S | S | * | * | trans | -105.8 | 158 | -171.5 | -121.8 | -111 | 0 | 0 | 0 | 113.3 | ||||
| 393 | G | 29.3 | Very low | 31.6 | Very low | 67 Ų | 67 | 134.7 Ų | 134.7 | 69% | 0.691 | 81% | 0.814 | S | S | * | * | trans | 90 | 146.9 | 164.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 394 | T | 31.6 | Very low | 31.9 | Very low | 144 Ų | 144 | 133 Ų | 133 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | cis | -154.8 | 170.4 | 9.2 | -15.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 395 | E | 35.2 | Very low | 31.9 | Very low | 184 Ų | 184 | 135.1 Ų | 135.1 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -79.9 | 155.2 | -171.9 | -53.4 | 158.6 | 124.9 | 0 | 0 | 114.1 | ||||
| 396 | A | 30.2 | Very low | 31.9 | Very low | 108 Ų | 108 | 131 Ų | 131 | 89% | 0.893 | 80% | 0.801 | S | S | * | * | trans | -159.2 | 128.2 | 152.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 397 | T | 33.6 | Very low | 32 | Very low | 124 Ų | 124 | 127 Ų | 127 | 76% | 0.761 | 80% | 0.8 | S | S | * | * | trans | -99.9 | 139.6 | 178.9 | -60.9 | 0 | 0 | 0 | 0 | 112 | T399 | T397-T399 HydrophobicContact CG2-CG2 4.45Š| ||
| 398 | T | 32.4 | Very low | 32.1 | Very low | 130 Ų | 130 | 126.4 Ų | 126.4 | 80% | 0.798 | 80% | 0.796 | S | S | * | * | trans | -172.7 | 101.8 | 146.4 | 40.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 399 | T | 31.1 | Very low | 32 | Very low | 106 Ų | 106 | 125.3 Ų | 125.3 | 65% | 0.65 | 79% | 0.788 | S | S | * | * | 74.3 | 112.7 | 83.4 | 60.4 | 0 | 0 | 0 | 0 | 117.2 | T397 | T397-T399 HydrophobicContact CG2-CG2 4.45Š| |||
| 400 | V | 32.6 | Very low | 32.3 | Very low | 135 Ų | 135 | 127.5 Ų | 127.5 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | 52.5 | 139.9 | 145.8 | -51.4 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 401 | T | 35.3 | Very low | 33.6 | Very low | 133 Ų | 133 | 128.6 Ų | 128.6 | 82% | 0.816 | 79% | 0.792 | S | S | * | * | -148.7 | 149.2 | 53.9 | 48.6 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 402 | D | 32.6 | Very low | 34.7 | Very low | 133 Ų | 133 | 125.5 Ų | 125.5 | 71% | 0.711 | 78% | 0.782 | S | S | * | * | trans | -86.8 | 155.7 | 166.9 | -173 | -17.9 | 0 | 0 | 0 | 110.9 | S404 | D402-S404 PolarHBondContact OD1-N 3.03Š| ||
| 403 | L | 35.3 | Very low | 34.6 | Very low | 159 Ų | 159 | 120.7 Ų | 120.7 | 83% | 0.832 | 77% | 0.77 | S | S | * | * | trans | -170.3 | 82.5 | 136 | -102.7 | 164.6 | 0 | 0 | 0 | 114.2 | ||||
| 404 | S | 34.1 | Very low | 34.6 | Very low | 77 Ų | 77 | 125.9 Ų | 125.9 | 54% | 0.538 | 78% | 0.777 | S | S | . | * | 56.6 | 150.9 | 127.5 | 82.1 | 0 | 0 | 0 | 0 | 125.8 | D402 | D402-S404 PolarHBondContact OD1-N 3.03Š| |||
| 405 | K | 34.3 | Very low | 34.5 | Very low | 210 Ų | 210 | 124.7 Ų | 124.7 | 91% | 0.913 | 77% | 0.774 | S | S | * | * | trans | 80.7 | 125.9 | 148.9 | -93.5 | 170.1 | 174.1 | 171.2 | 0 | 119.8 | ||||
| 406 | G | 28.6 | Very low | 34.2 | Very low | 70 Ų | 70 | 121.5 Ų | 121.5 | 72% | 0.722 | 77% | 0.773 | S | S | * | * | cis | 166.6 | 154.8 | -10.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 407 | A | 34 | Very low | 34.3 | Very low | 106 Ų | 106 | 121.3 Ų | 121.3 | 88% | 0.876 | 77% | 0.765 | S | S | * | * | trans | 41.4 | 150.4 | 156.8 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 408 | S | 31.1 | Very low | 35.2 | Very low | 101 Ų | 101 | 120.4 Ų | 120.4 | 71% | 0.706 | 76% | 0.761 | S | S | * | * | cis | -160.7 | 169.7 | 18.4 | 62.3 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 409 | S | 29.6 | Very low | 35.1 | Very low | 107 Ų | 107 | 122.3 Ų | 122.3 | 75% | 0.748 | 76% | 0.761 | S | S | * | * | trans | 71.6 | 145 | 142.8 | 52.5 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 410 | S | 33.9 | Very low | 35.3 | Very low | 117 Ų | 117 | 122.2 Ų | 122.2 | 82% | 0.818 | 76% | 0.76 | S | S | * | * | trans | -114.4 | -152.4 | -163.3 | -46.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 411 | P | 58.6 | Low | 35.5 | Very low | 119 Ų | 119 | 122.9 Ų | 122.9 | 77% | 0.773 | 76% | 0.758 | S | S | * | * | trans | -110 | -148.5 | -133.9 | 38.3 | -14.6 | 0 | 0 | 0 | 111.5 | ||||
| 412 | P | 53.3 | Low | 35.4 | Very low | 110 Ų | 110 | 124.3 Ų | 124.3 | 71% | 0.714 | 76% | 0.758 | S | S | * | * | cis | -142.2 | -164.3 | -3.3 | 40.7 | -17.8 | 0 | 0 | 0 | 117.1 | ||||
| 413 | S | 29.9 | Very low | 35.4 | Very low | 94 Ų | 94 | 121 Ų | 121 | 66% | 0.657 | 76% | 0.756 | S | S | * | * | trans | 99.8 | 117.6 | 148.5 | -70.2 | 0 | 0 | 0 | 0 | 123 | ||||
| 414 | E | 29.7 | Very low | 35.1 | Very low | 177 Ų | 177 | 123 Ų | 123 | 83% | 0.827 | 76% | 0.761 | S | S | * | * | 41.9 | 126.5 | 126.6 | -57.7 | 175.2 | 114.2 | 0 | 0 | 122.6 | |||||
| 415 | S | 28.8 | Very low | 35.2 | Very low | 119 Ų | 119 | 125.8 Ų | 125.8 | 83% | 0.832 | 78% | 0.775 | S | S | * | * | 150.4 | 150.9 | 107.3 | 62.5 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 416 | S | 28.5 | Very low | 35.5 | Very low | 117 Ų | 117 | 122 Ų | 122 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | 57.6 | 123 | 146.1 | -135 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 417 | S | 33.7 | Very low | 35.5 | Very low | 104 Ų | 104 | 122 Ų | 122 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | trans | -73.6 | 168.2 | 142.4 | -36.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 418 | P | 50.9 | Low | 35.5 | Very low | 105 Ų | 105 | 122.9 Ų | 122.9 | 68% | 0.682 | 77% | 0.771 | S | S | * | * | -153 | 175.3 | 57.4 | 42.4 | -20.9 | 0 | 0 | 0 | 118.3 | |||||
| 419 | E | 32.2 | Very low | 35.6 | Very low | 170 Ų | 170 | 122.8 Ų | 122.8 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | trans | 56.6 | 152.9 | 140.6 | -78.2 | -179.9 | 129.4 | 0 | 0 | 122.6 | ||||
| 420 | T | 35.1 | Very low | 35.5 | Very low | 104 Ų | 104 | 121 Ų | 121 | 64% | 0.638 | 78% | 0.775 | S | S | * | * | cis | -161.8 | 161.7 | 13.1 | 9 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 421 | I | 35.5 | Very low | 35.6 | Very low | 149 Ų | 149 | 120.6 Ų | 120.6 | 76% | 0.764 | 77% | 0.772 | S | S | * | * | trans | 74.2 | 116.1 | 142.6 | -68.7 | 158 | 0 | 0 | 0 | 122.7 | ||||
| 422 | I | 34.4 | Very low | 34.6 | Very low | 162 Ų | 162 | 122.1 Ų | 122.1 | 83% | 0.831 | 77% | 0.774 | S | S | * | * | -173.3 | 123.9 | 114.4 | -81.3 | 153.4 | 0 | 0 | 0 | 103.3 | |||||
| 423 | G | 31.9 | Very low | 34.3 | Very low | 65 Ų | 65 | 122.7 Ų | 122.7 | 67% | 0.67 | 78% | 0.781 | S | S | * | * | cis | 95.9 | 123.4 | 42.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 424 | Q | 28.7 | Very low | 34.7 | Very low | 201 Ų | 201 | 126.1 Ų | 126.1 | 94% | 0.939 | 79% | 0.791 | S | S | * | * | cis | -154.6 | 167.5 | 2.2 | -86.1 | 179.3 | -36.6 | 0 | 0 | 111.8 | ||||
| 425 | V | 35.5 | Very low | 35.3 | Very low | 135 Ų | 135 | 120.7 Ų | 120.7 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -79.2 | 149.4 | 175 | 161 | 0 | 0 | 0 | 0 | 111 | ||||
| 426 | P | 41.7 | Very low | 36.1 | Very low | 131 Ų | 131 | 122.7 Ų | 122.7 | 85% | 0.851 | 78% | 0.783 | S | S | * | * | -151.2 | 178 | 70.9 | 37.6 | -14.6 | 0 | 0 | 0 | 116.9 | |||||
| 427 | G | 28.6 | Very low | 36.5 | Very low | 70 Ų | 70 | 126.5 Ų | 126.5 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | cis | 164.5 | 150 | -10.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 428 | S | 33.6 | Very low | 37.2 | Very low | 123 Ų | 123 | 127.8 Ų | 127.8 | 86% | 0.86 | 78% | 0.782 | S | S | * | * | trans | 73.6 | 124.5 | 157.9 | -146.7 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 429 | A | 32.5 | Very low | 36.5 | Very low | 99 Ų | 99 | 131.2 Ų | 131.2 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | 31.7 | 148.7 | 139.1 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 430 | G | 27.8 | Very low | 37.2 | Very low | 69 Ų | 69 | 131.7 Ų | 131.7 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | cis | 179.9 | -144.6 | 8.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 431 | S | 37.1 | Very low | 37.9 | Very low | 110 Ų | 110 | 132.7 Ų | 132.7 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | 75.5 | 140.8 | -179.3 | -170.8 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 432 | D | 37.6 | Very low | 37.9 | Very low | 150 Ų | 150 | 130.9 Ų | 130.9 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | cis | -153.9 | 161.2 | -26 | -100 | -49.5 | 0 | 0 | 0 | 108.3 | D434 | D432-D434 PolarHBondContact O-N 3Š| ||
| 433 | S | 45.9 | Very low | 38.1 | Very low | 123 Ų | 123 | 132.8 Ų | 132.8 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -83.6 | 111.7 | 174 | -74.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 434 | D | 39.5 | Very low | 38.2 | Very low | 165 Ų | 165 | 135.2 Ų | 135.2 | 88% | 0.882 | 81% | 0.809 | S | S | * | * | trans | -99.3 | 121.9 | 160.8 | -111.1 | -27.1 | 0 | 0 | 0 | 110.4 | D432 | D432-D434 PolarHBondContact O-N 3Š| ||
| 435 | G | 40.7 | Very low | 38.6 | Very low | 63 Ų | 63 | 131.6 Ų | 131.6 | 65% | 0.649 | 81% | 0.807 | S | S | * | * | trans | -84 | 126.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | F437 | G435-F437 PolarHBondContact O-N 2.81Š| ||
| 436 | I | 46 | Very low | 38.4 | Very low | 162 Ų | 162 | 128.8 Ų | 128.8 | 83% | 0.831 | 81% | 0.805 | S | S | * | * | trans | -73.7 | 97.6 | 172.5 | -59 | 175.9 | 0 | 0 | 0 | 108.9 | I438 | I436-I438 HydrophobicContact CG2-CG1 4.44Š| ||
| 437 | F | 37.3 | Very low | 38 | Very low | 197 Ų | 197 | 126.2 Ų | 126.2 | 86% | 0.864 | 80% | 0.802 | S | S | * | * | trans | -70.1 | 122.3 | 162.9 | -96 | -99.8 | 0 | 0 | 0 | 109.4 | G435 | G435-F437 PolarHBondContact O-N 2.81Š| ||
| 438 | I | 48.8 | Very low | 38.3 | Very low | 130 Ų | 130 | 132.5 Ų | 132.5 | 67% | 0.667 | 81% | 0.809 | S | S | * | * | trans | -94.4 | 108.7 | 160.7 | -61.7 | -179.4 | 0 | 0 | 0 | 106.8 | I436 F440 | I436-I438 HydrophobicContact CG2-CG1 4.44Å; I438-F440 PolarHBondContact O-N 2.78Å | ||
| 439 | E | 36.1 | Very low | 38.3 | Very low | 177 Ų | 177 | 132.1 Ų | 132.1 | 83% | 0.827 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -76 | 118.6 | 175.8 | -173 | 174 | -169 | 0 | 0 | 109.7 | ||
| 440 | F | 47.6 | Very low | 38.5 | Very low | 180 Ų | 180 | 135.8 Ų | 135.8 | 79% | 0.789 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 123.6 | 172.5 | -70.2 | -88.4 | 0 | 0 | 0 | 109.4 | I438 S442 | I438-F440 PolarHBondContact O-N 2.78Å; F440-S442 PolarHBondContact O-N 3.49Å |
| 441 | P | 49.4 | Very low | 38.8 | Very low | 125 Ų | 125 | 137.7 Ų | 137.7 | 81% | 0.812 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 121.9 | 172.6 | -24 | 34.6 | 0 | 0 | 0 | 110.6 | ||
| 442 | S | 35.2 | Very low | 38.6 | Very low | 111 Ų | 111 | 144 Ų | 144 | 78% | 0.776 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 137 | -179.2 | 40.8 | 0 | 0 | 0 | 0 | 111.6 | F440 S444 | F440-S442 PolarHBondContact O-N 3.49Å; S442-S444 PolarHBondContact O-N 3.07Å |
| 443 | H | 38.3 | Very low | 38.5 | Very low | 202 Ų | 202 | 143.4 Ų | 143.4 | 94% | 0.935 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 124.6 | 172.3 | -60.7 | -83.1 | 0 | 0 | 0 | 110.2 | ||
| 444 | S | 34.2 | Very low | 38.2 | Very low | 116 Ų | 116 | 142.1 Ų | 142.1 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -123.2 | 137.7 | 164.1 | 61.9 | 0 | 0 | 0 | 0 | 110.5 | S442 | S442-S444 PolarHBondContact O-N 3.07Š| ||
| 445 | S | 36.9 | Very low | 38.4 | Very low | 126 Ų | 126 | 144.5 Ų | 144.5 | 88% | 0.881 | 80% | 0.801 | S | S | * | * | trans | -73.9 | 128.5 | -171.1 | 109.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 446 | G | 30.7 | Very low | 38.2 | Very low | 76 Ų | 76 | 150 Ų | 150 | 78% | 0.784 | 81% | 0.81 | S | S | * | * | trans | -127.5 | 63 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | K448 | G446-K448 PolarHBondContact O-N 2.89Š| ||
| 447 | G | 35.2 | Very low | 37.8 | Very low | 76 Ų | 76 | 147.3 Ų | 147.3 | 78% | 0.784 | 81% | 0.805 | S | S | * | * | trans | -67.7 | 120.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 448 | K | 34.7 | Very low | 37.8 | Very low | 203 Ų | 203 | 144.1 Ų | 144.1 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -133.2 | 106.5 | 157.5 | -77.8 | -172.3 | 177.1 | 176.9 | 0 | 109.5 | G446 | G446-K448 PolarHBondContact O-N 2.89Š| ||
| 449 | S | 33.8 | Very low | 37.5 | Very low | 115 Ų | 115 | 148.2 Ų | 148.2 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | trans | -63.1 | 145.9 | 157.3 | 47.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 450 | L | 36.1 | Very low | 37.5 | Very low | 175 Ų | 175 | 146.8 Ų | 146.8 | 92% | 0.916 | 83% | 0.833 | S | S | * | * | trans | -150.1 | 146.6 | 152 | -106.9 | 171.3 | 0 | 0 | 0 | 109.2 | ||||
| 451 | S | 32.8 | Very low | 37 | Very low | 109 Ų | 109 | 145.1 Ų | 145.1 | 76% | 0.762 | 84% | 0.835 | S | S | * | * | trans | -85.1 | 148.1 | -150.2 | -60.7 | 0 | 0 | 0 | 0 | 115.5 | E453 | S451-E453 PolarHBondContact O-N 2.8Š| ||
| 452 | R | 34.5 | Very low | 36.3 | Very low | 244 Ų | 244 | 146.2 Ų | 146.2 | 92% | 0.921 | 84% | 0.837 | S | S | * | * | trans | -58.9 | 105.7 | 150.2 | 171.2 | -176.3 | 172.4 | -175.3 | -2 | 109.6 | ||||
| 453 | E | 35 | Very low | 36.4 | Very low | 137 Ų | 137 | 148.2 Ų | 148.2 | 64% | 0.64 | 84% | 0.84 | S | S | * | * | trans | -108.9 | 120.5 | 163.2 | 178.8 | 79.7 | 168.8 | 0 | 0 | 108 | S451 R455 | S451-E453 PolarHBondContact O-N 2.8Å; E453-R455 HydrophobicContact CG-CG 4.38Å; E453-R455 IonicContact OE1-CZ 2.7Å; E453-R455 IonicContact OE1-NE 3.77Å; E453-R455 PolarHBondContact OE1-NE 3.27Å; E453-R455 VanDerWaalsContact OE1-NE 3.08Å; E453-R455 IonicContact OE1-NH2 3.48Å; E453-R455 PolarHBondContact OE1-NH2 3.41Å | ||
| 454 | S | 39.2 | Very low | 36.3 | Very low | 96 Ų | 96 | 144.9 Ų | 144.9 | 67% | 0.671 | 83% | 0.834 | S | S | * | * | trans | -92.1 | 126.3 | 174.8 | 166.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 455 | R | 42.9 | Very low | 36.4 | Very low | 215 Ų | 215 | 146.8 Ų | 146.8 | 81% | 0.811 | 84% | 0.836 | S | S | * | * | trans | -133.2 | 120.8 | 162.8 | -68.9 | -165.5 | -179.8 | -148.2 | -3.9 | 112.5 | E453 | E453-R455 HydrophobicContact CG-CG 4.38Å; E453-R455 IonicContact OE1-CZ 2.7Å; E453-R455 IonicContact OE1-NE 3.77Å; E453-R455 PolarHBondContact OE1-NE 3.27Å; E453-R455 VanDerWaalsContact OE1-NE 3.08Å; E453-R455 IonicContact OE1-NH2 3.48Å; E453-R455 PolarHBondContact OE1-NH2 3.41Å | ||
| 456 | Q | 36.7 | Very low | 36.4 | Very low | 178 Ų | 178 | 148.3 Ų | 148.3 | 83% | 0.832 | 83% | 0.832 | S | S | * | * | trans | -72.3 | 155.9 | 169 | -76 | 164.3 | -56.8 | 0 | 0 | 111.1 | ||||
| 457 | S | 37.5 | Very low | 36.8 | Very low | 105 Ų | 105 | 153.8 Ų | 153.8 | 73% | 0.734 | 84% | 0.836 | S | S | * | * | trans | 33 | 122.1 | 134 | -164.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 458 | T | 37.5 | Very low | 36.9 | Very low | 130 Ų | 130 | 160.3 Ų | 160.3 | 80% | 0.798 | 84% | 0.841 | S | S | * | * | -171 | 139.5 | 112.3 | 13.6 | 0 | 0 | 0 | 0 | 113 | |||||
| 459 | V | 42.5 | Very low | 37.1 | Very low | 217 Ų | 217 | 156.5 Ų | 156.5 | 100% | 1.315 | 84% | 0.837 | S | S | * | * | trans | 62.3 | 0 | 165.7 | -171.9 | 0 | 0 | 0 | 0 | 117.2 |
Retrieved 459 of 459 residues in 107.2 ms
(Link to these results)